#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s4e s PRO 9 N 0.00 3.35 0.45 -1.46 0.04 -1.26 -1.01 135.00 135.11 1s4e s PRO 9 Ca 0.00 0.72 -0.05 0.00 0.04 0.00 0.00 61.00 61.71 1s4e s PRO 9 Cb 0.00 -2.05 0.10 0.00 0.04 0.00 0.00 34.50 32.58 1s4e s PRO 9 CO 0.00 -0.74 0.62 0.41 0.04 0.00 0.00 177.00 177.32 1s4e n GLY 10 N -2.69 -0.46 3.22 0.56 0.00 -0.97 -4.22 105.19 100.63 1s4e n GLY 10 Ca 0.06 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.16 1s4e n GLY 10 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1s4e s ARG 11 N -4.20 1.12 -0.22 1.61 1.04 -0.64 -2.06 118.95 115.59 1s4e s ARG 11 Ca 0.37 -1.50 -0.12 0.00 -1.04 0.00 0.00 55.73 53.43 1s4e s ARG 11 Cb -0.01 0.28 0.07 0.00 -2.04 0.00 0.00 34.95 33.25 1s4e s ARG 11 CO 0.25 -0.36 0.54 0.08 -0.04 0.00 0.00 175.30 175.77 1s4e s VAL 12 N -4.10 -0.02 -0.15 4.99 1.01 -1.26 -4.45 120.40 116.41 1s4e s VAL 12 Ca 0.31 0.05 -0.19 0.00 0.00 0.00 0.00 61.98 62.15 1s4e s VAL 12 Cb 0.06 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 1s4e s VAL 12 CO 0.07 0.02 0.55 0.21 0.00 0.00 0.00 175.10 175.95 1s4e s ASN 13 N 1.53 6.69 -0.02 3.32 2.47 -1.26 -4.50 114.94 123.17 1s4e s ASN 13 Ca -0.10 0.82 -0.22 0.00 0.42 0.00 0.00 52.86 53.78 1s4e s ASN 13 Cb -0.07 -2.32 -0.23 0.00 -1.45 0.00 0.00 41.25 37.19 1s4e s ASN 13 CO -0.16 -0.12 1.08 0.25 -3.72 0.00 0.00 177.10 174.43 1s4e h LEU 14 N 7.39 0.35 -7.26 3.21 5.85 -1.98 -3.45 115.31 119.42 1s4e h LEU 14 Ca -0.37 -0.75 0.04 0.00 0.84 0.00 0.00 57.88 57.65 1s4e h LEU 14 Cb 1.17 -0.11 -0.11 0.00 0.37 0.00 0.00 40.66 41.98 1s4e h LEU 14 CO 0.75 1.05 0.30 -0.51 -0.34 0.00 0.00 178.44 179.69 1s4e s ILE 15 N -3.25 0.00 0.00 4.05 1.10 -1.26 -4.94 121.20 116.89 1s4e s ILE 15 Ca -0.15 -0.26 0.00 0.00 -0.51 0.00 0.00 60.65 59.74 1s4e s ILE 15 Cb 0.02 -1.29 0.00 0.00 0.15 0.00 0.00 42.46 41.35 1s4e s ILE 15 CO 0.77 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 174.21 1s4e n GLY 16 N -0.38 0.70 3.86 1.50 0.00 -1.26 -4.65 105.19 104.96 1s4e n GLY 16 Ca -0.12 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 1s4e n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1s4e s GLU 17 N -1.63 3.63 -1.19 1.61 2.56 -1.26 -4.50 118.70 117.93 1s4e s GLU 17 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.97 55.02 1s4e s GLU 17 Cb 0.00 -3.21 -0.01 0.00 2.00 0.00 0.00 34.13 32.91 1s4e s GLU 17 CO 0.00 0.73 0.98 0.72 -0.56 0.00 0.00 175.26 177.13 1s4e n HIS 18 N 1.99 -2.20 0.00 5.30 8.25 -1.26 -4.91 115.22 122.39 1s4e n HIS 18 Ca -0.18 0.93 0.00 0.00 -0.26 0.00 0.00 57.72 58.21 1s4e n HIS 18 Cb 0.54 -4.98 0.00 0.00 1.12 0.00 0.00 29.99 26.67 1s4e n HIS 18 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1s4e n THR 19 N -4.06 0.00 0.09 1.59 -1.04 -1.26 -4.76 114.28 104.84 1s4e n THR 19 Ca -0.27 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.66 1s4e n THR 19 Cb 0.67 -0.09 0.02 0.00 -1.82 0.00 0.00 70.33 69.11 1s4e n THR 19 CO 0.00 0.00 0.00 -2.24 -0.64 0.00 0.00 175.07 172.19 1s4e h ASP 20 N 0.00 0.25 0.13 8.00 -0.00 -1.86 -1.22 116.42 121.72 1s4e h ASP 20 Ca 0.00 -0.19 0.00 0.00 -0.00 0.00 0.00 57.03 56.84 1s4e h ASP 20 Cb 0.13 -0.08 0.00 0.00 -0.00 0.00 0.00 39.33 39.39 1s4e h ASP 20 CO 0.00 0.96 0.00 0.00 -0.00 0.00 0.00 179.24 180.20 1s4e n TYR 21 N -3.70 0.00 -1.06 4.15 0.18 -1.26 -1.65 117.16 113.82 1s4e n TYR 21 Ca -0.03 0.00 0.09 0.00 1.88 0.00 0.00 57.90 59.84 1s4e n TYR 21 Cb 0.76 -0.11 0.13 0.00 -0.38 0.00 0.00 39.34 39.75 1s4e n TYR 21 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1s4e n THR 22 N -1.11 1.77 -2.98 -3.48 -2.24 -1.10 -4.81 114.28 100.34 1s4e n THR 22 Ca 0.13 -2.12 -0.12 0.00 -2.27 0.00 0.00 64.05 59.67 1s4e n THR 22 Cb 0.10 -0.18 0.06 0.00 -2.10 0.00 0.00 70.33 68.21 1s4e n THR 22 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1s4e n TYR 23 N -1.34 -1.56 -2.40 4.78 4.02 -0.66 -0.37 117.16 119.63 1s4e n TYR 23 Ca 0.15 0.66 0.00 0.00 -0.01 0.00 0.00 57.90 58.69 1s4e n TYR 23 Cb 0.62 -4.13 0.00 0.00 -0.02 0.00 0.00 39.34 35.82 1s4e n TYR 23 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1s4e n GLY 24 N -1.11 4.31 3.91 2.72 0.00 -0.48 -3.89 105.19 110.65 1s4e n GLY 24 Ca -0.19 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.48 1s4e n GLY 24 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s4e s TYR 25 N 1.60 3.53 0.00 1.61 1.51 -1.26 -1.46 117.35 122.87 1s4e s TYR 25 Ca 0.00 0.32 0.00 0.00 -1.01 0.00 0.00 57.07 56.38 1s4e s TYR 25 Cb 0.00 -1.81 0.00 0.00 -0.11 0.00 0.00 41.96 40.04 1s4e s TYR 25 CO 0.00 0.59 0.00 1.55 -1.11 0.00 0.00 175.55 176.58 1s4e n VAL 26 N 0.47 0.00 -0.50 0.71 3.14 -0.08 -4.54 118.33 117.53 1s4e n VAL 26 Ca -0.07 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.31 1s4e n VAL 26 Cb 0.52 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.30 1s4e n VAL 26 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1s4e n PRO 28 N 0.00 0.00 -4.63 1.45 -0.04 -1.20 -0.80 135.00 129.78 1s4e n PRO 28 Ca 0.00 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 1s4e n PRO 28 Cb 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.33 1s4e n PRO 28 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1s4e s ALA 30 N -1.00 2.59 0.48 0.55 0.00 -1.26 -1.37 121.76 121.74 1s4e s ALA 30 Ca 0.00 -1.21 0.06 0.00 0.00 0.00 0.00 51.96 50.80 1s4e s ALA 30 Cb 0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 1s4e s ALA 30 CO 0.00 0.57 0.26 0.96 0.00 0.00 0.00 175.76 177.55 1s4e s ILE 31 N -0.94 1.94 -1.11 0.00 -4.36 -0.87 -0.54 121.20 115.31 1s4e s ILE 31 Ca 0.15 -1.63 -0.03 0.00 -0.26 0.00 0.00 60.65 58.89 1s4e s ILE 31 Cb -0.10 -2.57 0.27 0.00 1.25 0.00 0.00 42.46 41.30 1s4e s ILE 31 CO 0.06 0.00 1.92 -0.90 0.24 0.00 0.00 174.94 176.26 1s4e n ASP 32 N -1.47 7.35 -3.52 4.36 5.68 -0.86 -4.44 116.55 123.66 1s4e n ASP 32 Ca -0.03 -3.52 -0.22 0.00 -0.50 0.00 0.00 54.79 50.53 1s4e n ASP 32 Cb 0.64 -1.24 -0.14 0.00 -1.14 0.00 0.00 41.12 39.25 1s4e n ASP 32 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1s4e s LEU 33 N -3.53 0.08 0.13 -2.12 1.43 -1.26 -4.91 118.68 108.50 1s4e s LEU 33 Ca 0.42 -0.53 0.04 0.00 -1.03 0.00 0.00 54.13 53.04 1s4e s LEU 33 Cb 0.17 0.14 -0.04 0.00 0.03 0.00 0.00 46.19 46.49 1s4e s LEU 33 CO -0.09 -0.35 0.10 -0.31 0.23 0.00 0.00 176.35 175.92 1s4e s TYR 34 N 2.25 3.13 0.00 0.29 1.51 -1.26 -2.30 117.35 120.98 1s4e s TYR 34 Ca 0.06 0.01 0.00 0.00 -1.01 0.00 0.00 57.07 56.13 1s4e s TYR 34 Cb -0.16 -1.55 0.00 0.00 -0.11 0.00 0.00 41.96 40.15 1s4e s TYR 34 CO -0.17 0.52 0.00 2.41 -1.11 0.00 0.00 175.55 177.20 1s4e n THR 35 N 0.04 0.00 -3.85 -0.71 -1.04 -0.18 -1.00 114.28 107.55 1s4e n THR 35 Ca -0.09 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.56 1s4e n THR 35 Cb 0.53 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.91 1s4e n THR 35 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1s4e s LYS 41 N 4.92 2.43 0.22 -2.82 -0.14 -1.26 -2.53 119.74 120.56 1s4e s LYS 41 Ca 0.00 -1.31 0.03 0.00 -1.36 0.00 0.00 55.97 53.34 1s4e s LYS 41 Cb 0.00 -3.31 -0.05 0.00 -1.68 0.00 0.00 37.83 32.79 1s4e s LYS 41 CO 0.00 -0.69 -0.01 -0.47 -0.76 0.00 0.00 175.35 173.42 1s4e s TYR 42 N 1.28 1.52 0.17 3.18 6.04 -1.08 -4.88 117.35 123.58 1s4e s TYR 42 Ca -0.03 -0.93 -0.15 0.00 0.04 0.00 0.00 57.07 56.01 1s4e s TYR 42 Cb -0.20 -0.88 0.09 0.00 -1.04 0.00 0.00 41.96 39.94 1s4e s TYR 42 CO -0.00 -0.05 1.78 0.38 -1.54 0.00 0.00 175.55 176.11 1s4e h ASP 43 N 2.50 0.30 -3.04 4.32 2.03 -1.97 0.22 116.42 120.78 1s4e h ASP 43 Ca -0.38 0.03 -0.10 0.00 -0.73 0.00 0.00 57.03 55.84 1s4e h ASP 43 Cb 1.22 -0.03 -0.02 0.00 -0.83 0.00 0.00 39.33 39.67 1s4e h ASP 43 CO 0.64 0.22 -0.08 2.29 -1.03 0.00 0.00 179.24 181.28 1s4e n LYS 44 N -4.92 1.19 -4.34 4.15 -0.00 -1.26 -4.03 118.16 108.94 1s4e n LYS 44 Ca 0.03 -0.61 -0.34 0.00 -0.00 0.00 0.00 58.31 57.38 1s4e n LYS 44 Cb 0.12 0.27 -0.10 0.00 -0.00 0.00 0.00 35.03 35.32 1s4e n LYS 44 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1s4e s VAL 45 N -1.64 4.25 -0.22 0.58 1.01 -1.26 -2.49 120.40 120.63 1s4e s VAL 45 Ca 0.02 -0.26 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 1s4e s VAL 45 Cb 0.00 -2.82 0.09 0.00 0.00 0.00 0.00 36.38 33.65 1s4e s VAL 45 CO 0.02 0.56 0.48 -1.10 0.00 0.00 0.00 175.10 175.05 1s4e s GLN 46 N -0.41 0.42 0.00 2.72 1.11 -1.21 -4.98 119.66 117.31 1s4e s GLN 46 Ca 0.07 1.06 0.00 0.00 0.01 0.00 0.00 55.36 56.51 1s4e s GLN 46 Cb -0.12 0.32 0.00 0.00 -1.01 0.00 0.00 33.01 32.19 1s4e s GLN 46 CO 0.02 -0.21 0.00 1.47 0.01 0.00 0.00 175.29 176.58 1s4e n LEU 47 N 5.03 0.00 0.00 2.90 -0.00 -1.26 -4.27 117.00 119.40 1s4e n LEU 47 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.87 1s4e n LEU 47 Cb 0.52 0.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.98 1s4e n LEU 47 CO 0.01 -0.05 0.00 1.33 -0.00 0.00 0.00 177.39 178.69 1s4e n VAL 73 N -1.14 0.00 2.00 1.47 0.24 -1.26 -5.12 118.33 114.52 1s4e n VAL 73 Ca 0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.43 1s4e n VAL 73 Cb 0.00 0.00 0.79 0.00 -1.47 0.00 0.00 33.84 33.16 1s4e n VAL 73 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1s4e n LYS 74 N 0.00 1.00 -0.03 7.34 4.76 -1.26 -3.86 118.16 126.10 1s4e n LYS 74 Ca 0.00 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.31 1s4e n LYS 74 Cb 0.00 -1.41 -0.09 0.00 -1.84 0.00 0.00 35.03 31.68 1s4e n LYS 74 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1s4e h GLY 75 N 5.17 0.16 1.29 0.72 0.00 -1.97 -2.54 103.07 105.90 1s4e h GLY 75 Ca 0.00 -0.18 -0.09 0.00 0.00 0.00 0.00 47.33 47.05 1s4e h GLY 75 CO 0.00 0.17 -0.08 -2.08 0.00 0.00 0.00 176.54 174.54 1s4e h VAL 76 N -0.36 1.26 -0.50 4.60 2.07 -1.92 -2.31 116.25 119.08 1s4e h VAL 76 Ca 0.00 -1.16 0.02 0.00 0.82 0.00 0.00 66.70 66.38 1s4e h VAL 76 Cb 0.66 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 1s4e h VAL 76 CO 0.02 0.40 0.31 0.25 0.02 0.00 0.00 177.57 178.57 1s4e h LEU 77 N 0.76 0.51 -1.29 2.57 6.46 -1.69 -1.73 115.31 120.90 1s4e h LEU 77 Ca 0.13 -0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.82 1s4e h LEU 77 Cb 0.58 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 1s4e h LEU 77 CO 0.04 0.37 -0.35 -0.25 -0.62 0.00 0.00 178.44 177.62 1s4e h TRP 78 N 0.62 0.00 0.14 1.25 2.91 -1.16 -2.33 115.95 117.38 1s4e h TRP 78 Ca 0.20 0.00 -0.33 0.00 1.13 0.00 0.00 58.89 59.88 1s4e h TRP 78 Cb -0.01 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 28.64 1s4e h TRP 78 CO -0.06 0.35 -1.71 -0.24 -1.03 0.00 0.00 178.44 175.76 1s4e h VAL 79 N 0.00 0.96 -0.66 2.65 3.04 -1.27 -3.02 116.25 117.94 1s4e h VAL 79 Ca -0.00 -2.60 -0.07 0.00 -1.01 0.00 0.00 66.70 63.02 1s4e h VAL 79 Cb 0.64 2.70 -0.03 0.00 -2.01 0.00 0.00 31.29 32.59 1s4e h VAL 79 CO 0.05 0.82 0.14 -0.07 -1.01 0.00 0.00 177.57 177.50 1s4e h LEU 80 N 0.08 1.01 -0.53 3.16 3.38 -1.32 -2.70 115.31 118.39 1s4e h LEU 80 Ca -0.32 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.35 1s4e h LEU 80 Cb 2.05 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 42.52 1s4e h LEU 80 CO 0.15 0.98 -0.01 0.40 0.09 0.00 0.00 178.44 180.05 1s4e h ILE 81 N 1.01 1.26 0.00 1.22 2.04 -1.54 -2.88 117.51 118.62 1s4e h ILE 81 Ca 0.21 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1s4e h ILE 81 Cb 0.38 0.93 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 1s4e h ILE 81 CO 0.00 0.40 0.00 1.56 0.00 0.00 0.00 178.15 180.11 1s4e h GLN 82 N 0.82 0.00 0.06 2.37 1.08 -1.47 -3.17 115.11 114.80 1s4e h GLN 82 Ca 0.15 0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 57.11 1s4e h GLN 82 Cb 0.55 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 1s4e h GLN 82 CO 0.03 0.00 -1.07 0.93 -0.95 0.00 0.00 178.83 177.77 1s4e h GLU 83 N 0.00 0.32 0.00 1.46 4.39 -1.26 -3.49 114.58 116.01 1s4e h GLU 83 Ca 0.00 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.28 1s4e h GLU 83 Cb 0.56 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 1s4e h GLU 83 CO 0.00 1.14 0.00 0.41 -1.16 0.00 0.00 179.01 179.40 1s4e n GLY 84 N 1.19 2.20 0.00 -3.84 0.00 -1.20 -5.12 105.19 98.42 1s4e n GLY 84 Ca -0.07 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1s4e n GLY 84 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1s4e n TYR 85 N 0.00 0.00 -3.24 1.61 0.53 -1.25 -4.89 117.16 109.92 1s4e n TYR 85 Ca 0.00 0.00 -0.39 0.00 -1.02 0.00 0.00 57.90 56.49 1s4e n TYR 85 Cb 0.00 0.00 -0.06 0.00 -1.03 0.00 0.00 39.34 38.25 1s4e n TYR 85 CO 0.00 0.00 0.00 0.15 -1.02 0.00 0.00 176.86 175.99 1s4e s LYS 86 N 0.00 4.33 0.13 -0.72 3.01 -1.26 -4.54 119.74 120.69 1s4e s LYS 86 Ca 0.00 0.55 -0.09 0.00 -1.01 0.00 0.00 55.97 55.41 1s4e s LYS 86 Cb 0.00 -3.46 -0.00 0.00 -1.01 0.00 0.00 37.83 33.35 1s4e s LYS 86 CO 0.00 0.07 0.25 0.96 0.51 0.00 0.00 175.35 177.14 1s4e s ILE 87 N 0.88 0.10 0.00 2.17 -4.36 -1.26 -5.03 121.20 113.70 1s4e s ILE 87 Ca 0.28 -1.26 0.00 0.00 -0.26 0.00 0.00 60.65 59.42 1s4e s ILE 87 Cb -0.16 -1.59 0.00 0.00 1.25 0.00 0.00 42.46 41.96 1s4e s ILE 87 CO 0.12 -0.45 0.00 0.61 0.24 0.00 0.00 174.94 175.46 1s4e n GLY 88 N -0.15 3.91 0.00 6.27 0.00 -1.26 -5.14 105.19 108.82 1s4e n GLY 88 Ca -0.11 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.72 1s4e n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s4e n GLY 89 N 5.00 1.29 0.00 -0.02 0.00 0.77 -4.90 105.19 107.33 1s4e n GLY 89 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.45 1s4e n GLY 89 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1s4e n LEU 90 N 0.00 0.00 -4.40 0.99 -0.00 -1.04 -2.62 117.00 109.93 1s4e n LEU 90 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 56.01 55.69 1s4e n LEU 90 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.28 1s4e n LEU 90 CO 0.00 0.00 -0.50 -0.54 -0.00 0.00 0.00 177.39 176.35 1s4e s LYS 91 N -2.00 2.39 0.00 1.47 -0.14 -1.26 -3.35 119.74 116.85 1s4e s LYS 91 Ca 0.00 -0.79 0.00 0.00 -1.36 0.00 0.00 55.97 53.82 1s4e s LYS 91 Cb 0.00 -2.25 0.00 0.00 -1.68 0.00 0.00 37.83 33.90 1s4e s LYS 91 CO 0.00 0.57 0.00 0.41 -0.76 0.00 0.00 175.35 175.57 1s4e n GLY 92 N 2.43 -1.08 3.30 -3.33 0.00 -1.26 -4.83 105.19 100.42 1s4e n GLY 92 Ca -0.17 -0.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.85 1s4e n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s4e s ILE 94 N -3.00 0.04 0.09 -0.61 1.01 -1.26 -4.91 121.20 112.56 1s4e s ILE 94 Ca 0.00 -0.32 -0.26 0.00 0.00 0.00 0.00 60.65 60.07 1s4e s ILE 94 Cb 0.00 -0.69 0.08 0.00 0.01 0.00 0.00 42.46 41.86 1s4e s ILE 94 CO 0.00 -0.18 0.95 0.42 0.00 0.00 0.00 174.94 176.14 1s4e s THR 95 N -1.09 0.00 -5.00 2.92 -4.23 -1.26 -5.20 115.64 101.77 1s4e s THR 95 Ca -0.11 -0.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.97 1s4e s THR 95 Cb -0.04 -1.67 0.00 0.00 1.34 0.00 0.00 72.50 72.13 1s4e s THR 95 CO 0.05 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.74 1s4e n GLY 96 N -0.40 -2.06 0.25 3.99 0.00 -1.26 -4.50 105.19 101.21 1s4e n GLY 96 Ca -0.07 -1.31 0.14 0.00 0.00 0.00 0.00 46.02 44.78 1s4e n GLY 96 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1s4e h ASP 97 N 0.00 0.00 -3.60 1.61 3.32 -1.41 -3.47 116.42 112.86 1s4e h ASP 97 Ca 0.00 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 56.43 1s4e h ASP 97 Cb 0.00 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.41 1s4e h ASP 97 CO 0.00 0.11 -0.43 -0.22 -1.72 0.00 0.00 179.24 176.97 1s4e s LEU 98 N -6.54 4.11 0.56 1.55 2.96 -1.06 -4.76 118.68 115.49 1s4e s LEU 98 Ca 0.00 0.19 -0.17 0.00 -0.22 0.00 0.00 54.13 53.93 1s4e s LEU 98 Cb 0.10 -2.20 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 1s4e s LEU 98 CO 0.58 0.01 1.06 -2.16 -1.32 0.00 0.00 176.35 174.53 1s4e s PRO 99 N 1.23 3.44 -0.11 0.98 0.04 -1.26 -4.93 135.00 134.40 1s4e s PRO 99 Ca 0.10 1.28 -0.05 0.00 0.04 0.00 0.00 61.00 62.37 1s4e s PRO 99 Cb -0.14 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1s4e s PRO 99 CO 0.06 -0.72 0.09 -0.51 0.04 0.00 0.00 177.00 175.96 1s4e s LEU 100 N -4.17 4.07 -1.55 -3.56 1.02 -1.26 -4.35 118.68 108.88 1s4e s LEU 100 Ca 0.65 0.34 -0.03 0.00 0.02 0.00 0.00 54.13 55.12 1s4e s LEU 100 Cb -0.17 -1.97 0.00 0.00 0.02 0.00 0.00 46.19 44.07 1s4e s LEU 100 CO 0.31 0.40 0.38 0.61 0.02 0.00 0.00 176.35 178.07 1s4e n GLY 101 N 2.06 -0.45 0.04 -3.19 0.00 -1.26 -4.91 105.19 97.47 1s4e n GLY 101 Ca -0.19 0.03 0.04 0.00 0.00 0.00 0.00 46.02 45.90 1s4e n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s4e n ALA 102 N -2.95 2.35 0.00 4.61 0.00 -1.26 -4.91 120.51 118.34 1s4e n ALA 102 Ca -0.15 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1s4e n ALA 102 Cb 0.64 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1s4e n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s4e n GLY 103 N 1.49 1.00 1.49 0.00 0.00 -1.26 -3.01 105.19 104.90 1s4e n GLY 103 Ca -0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.97 1s4e n GLY 103 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s4e n LEU 104 N 0.00 4.86 -3.72 0.99 4.77 -1.26 -4.72 117.00 117.92 1s4e n LEU 104 Ca 0.00 -2.77 -0.32 0.00 -0.03 0.00 0.00 56.01 52.90 1s4e n LEU 104 Cb 0.00 -0.60 0.03 0.00 -2.33 0.00 0.00 43.42 40.53 1s4e n LEU 104 CO 0.00 0.70 -0.08 -0.24 -1.33 0.00 0.00 177.39 176.44 1s4e n SER 105 N 0.47 -5.26 -0.25 -1.43 2.88 -1.26 -1.63 113.62 107.15 1s4e n SER 105 Ca 0.25 -1.00 0.11 0.00 -1.33 0.00 0.00 58.87 56.89 1s4e n SER 105 Cb 1.00 -3.06 0.38 0.00 -0.75 0.00 0.00 64.21 61.77 1s4e n SER 105 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1s4e h SER 106 N -1.74 0.65 -0.47 -3.46 4.64 -1.95 -2.39 113.55 108.84 1s4e h SER 106 Ca -0.63 0.03 0.06 0.00 -0.47 0.00 0.00 61.79 60.78 1s4e h SER 106 Cb 1.35 -0.10 -0.09 0.00 -0.31 0.00 0.00 62.40 63.25 1s4e h SER 106 CO 0.47 0.35 -0.52 0.77 -0.87 0.00 0.00 176.83 177.03 1s4e h SER 107 N 0.70 -1.75 -0.16 4.97 4.64 -1.94 -1.53 113.55 118.49 1s4e h SER 107 Ca 0.41 0.25 -0.04 0.00 -0.47 0.00 0.00 61.79 61.94 1s4e h SER 107 Cb 0.62 0.74 -0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1s4e h SER 107 CO -0.18 -0.38 -0.05 0.00 -0.87 0.00 0.00 176.83 175.35 1s4e h ALA 108 N 0.18 0.22 -0.94 5.18 0.00 -1.82 -0.58 119.26 121.50 1s4e h ALA 108 Ca 0.11 -0.25 0.17 0.00 0.00 0.00 0.00 54.91 54.94 1s4e h ALA 108 Cb 0.58 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.24 1s4e h ALA 108 CO -0.63 -0.01 0.60 1.03 0.00 0.00 0.00 179.25 180.24 1s4e h SER 109 N 0.00 0.67 0.11 0.00 0.87 -1.26 -0.52 113.55 113.42 1s4e h SER 109 Ca 0.04 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1s4e h SER 109 Cb 0.49 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1s4e h SER 109 CO 0.02 0.30 -0.05 0.15 -0.53 0.00 0.00 176.83 176.71 1s4e h PHE 110 N 0.68 -0.13 -0.53 2.24 -0.00 -1.18 -1.66 116.94 116.36 1s4e h PHE 110 Ca 0.50 -0.00 0.09 0.00 -0.00 0.00 0.00 57.97 58.55 1s4e h PHE 110 Cb 0.85 0.04 -0.10 0.00 -0.00 0.00 0.00 35.95 36.74 1s4e h PHE 110 CO -0.00 0.20 -0.41 0.93 -0.00 0.00 0.00 178.31 179.03 1s4e h GLU 111 N -0.99 -0.23 -0.00 1.11 5.08 -0.74 0.27 114.58 119.08 1s4e h GLU 111 Ca -0.01 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1s4e h GLU 111 Cb 0.39 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1s4e h GLU 111 CO 0.02 -0.15 -0.10 1.33 -1.00 0.00 0.00 179.01 179.11 1s4e n VAL 112 N -5.41 0.00 -0.09 3.13 0.24 -0.23 -2.10 118.33 113.86 1s4e n VAL 112 Ca 0.02 -0.01 -0.13 0.00 -2.04 0.00 0.00 64.34 62.18 1s4e n VAL 112 Cb 0.35 -0.32 -0.04 0.00 -1.47 0.00 0.00 33.84 32.36 1s4e n VAL 112 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1s4e h GLY 113 N 5.00 0.80 1.04 7.63 0.00 -0.02 -2.41 103.07 115.11 1s4e h GLY 113 Ca 0.00 -0.82 -0.17 0.00 0.00 0.00 0.00 47.33 46.33 1s4e h GLY 113 CO 0.00 0.74 -0.55 -2.22 0.00 0.00 0.00 176.54 174.51 1s4e h ILE 114 N 0.48 1.31 -0.79 2.60 1.08 -0.33 -2.66 117.51 119.20 1s4e h ILE 114 Ca 0.05 -1.78 -0.04 0.00 -0.39 0.00 0.00 64.86 62.70 1s4e h ILE 114 Cb 0.88 1.90 -0.04 0.00 -3.07 0.00 0.00 36.82 36.49 1s4e h ILE 114 CO 0.08 0.56 0.34 0.25 -0.69 0.00 0.00 178.15 178.69 1s4e h LEU 115 N 0.42 1.07 -1.16 1.44 6.46 -1.52 -2.54 115.31 119.49 1s4e h LEU 115 Ca -0.01 -0.16 -0.08 0.00 -0.12 0.00 0.00 57.88 57.51 1s4e h LEU 115 Cb 1.17 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.82 1s4e h LEU 115 CO 0.12 0.94 -0.37 -0.08 -0.62 0.00 0.00 178.44 178.43 1s4e h GLU 116 N 1.14 0.00 -0.23 1.25 4.57 -1.41 -0.94 114.58 118.97 1s4e h GLU 116 Ca 0.27 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 58.26 1s4e h GLU 116 Cb 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1s4e h GLU 116 CO -0.03 0.37 -0.61 0.28 -1.18 0.00 0.00 179.01 177.84 1s4e h VAL 117 N 0.00 1.29 -0.26 0.32 2.07 -1.12 -0.70 116.25 117.85 1s4e h VAL 117 Ca -0.00 -1.82 -0.12 0.00 0.82 0.00 0.00 66.70 65.57 1s4e h VAL 117 Cb 0.76 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 1s4e h VAL 117 CO 0.05 0.58 -0.34 -0.07 0.02 0.00 0.00 177.57 177.81 1s4e h LEU 118 N 0.57 0.59 -0.66 2.57 3.38 -1.28 -2.57 115.31 117.92 1s4e h LEU 118 Ca -0.00 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.58 1s4e h LEU 118 Cb 1.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1s4e h LEU 118 CO 0.13 0.89 -0.52 -1.13 0.09 0.00 0.00 178.44 177.89 1s4e h ASN 119 N 0.48 0.43 0.27 -0.43 -1.24 -1.04 -2.38 115.58 111.67 1s4e h ASN 119 Ca 0.05 -0.22 -0.29 0.00 0.71 0.00 0.00 56.30 56.56 1s4e h ASN 119 Cb 0.82 -0.12 0.02 0.00 0.73 0.00 0.00 38.32 39.77 1s4e h ASN 119 CO 0.07 0.88 -1.22 1.56 -1.29 0.00 0.00 177.43 177.43 1s4e h GLN 120 N 0.30 0.51 0.17 6.67 7.50 -1.09 -2.60 115.11 126.57 1s4e h GLN 120 Ca 0.01 -0.71 -0.34 0.00 0.50 0.00 0.00 58.65 58.11 1s4e h GLN 120 Cb 1.02 0.24 0.00 0.00 0.05 0.00 0.00 27.48 28.80 1s4e h GLN 120 CO 0.09 1.31 -1.67 -0.07 -1.50 0.00 0.00 178.83 176.99 1s4e h LEU 121 N 0.22 0.55 -2.62 1.46 3.38 -1.48 -3.33 115.31 113.49 1s4e h LEU 121 Ca -0.17 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.01 1s4e h LEU 121 Cb 1.90 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.47 1s4e h LEU 121 CO 0.22 1.66 0.00 -1.22 0.09 0.00 0.00 178.44 179.20 1s4e n TYR 122 N -3.54 0.80 -2.89 1.13 4.02 -0.90 -4.99 117.16 110.78 1s4e n TYR 122 Ca -0.22 -0.42 -0.22 0.00 -0.01 0.00 0.00 57.90 57.04 1s4e n TYR 122 Cb 1.07 -0.00 0.02 0.00 -0.02 0.00 0.00 39.34 40.41 1s4e n TYR 122 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1s4e n ASN 123 N 1.54 -5.93 0.23 7.72 2.85 -1.05 -4.89 115.26 115.74 1s4e n ASN 123 Ca 0.22 -0.22 0.16 0.00 -0.11 0.00 0.00 54.58 54.62 1s4e n ASN 123 Cb 0.61 -4.83 0.81 0.00 1.24 0.00 0.00 39.78 37.61 1s4e n ASN 123 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1s4e h LEU 124 N -1.04 0.00 -1.13 1.20 3.38 -1.71 -3.46 115.31 112.55 1s4e h LEU 124 Ca -0.51 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 56.97 1s4e h LEU 124 Cb 1.36 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.05 1s4e h LEU 124 CO 0.57 0.00 -0.79 -3.20 0.09 0.00 0.00 178.44 175.11 1s4e n ASN 125 N -2.60 -3.96 -4.77 -0.43 2.85 -1.26 -4.91 115.26 100.17 1s4e n ASN 125 Ca -0.01 -0.84 -0.38 0.00 -0.11 0.00 0.00 54.58 53.24 1s4e n ASN 125 Cb 0.09 -3.64 -0.05 0.00 1.24 0.00 0.00 39.78 37.42 1s4e n ASN 125 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1s4e s ILE 126 N -3.37 3.83 0.22 -1.44 1.01 -1.26 -4.97 121.20 115.23 1s4e s ILE 126 Ca 0.59 1.56 -0.31 0.00 0.00 0.00 0.00 60.65 62.49 1s4e s ILE 126 Cb -0.30 -3.88 -0.10 0.00 0.01 0.00 0.00 42.46 38.18 1s4e s ILE 126 CO 0.85 0.16 1.54 -0.62 0.00 0.00 0.00 174.94 176.87 1s4e s ASP 127 N -1.40 6.56 0.29 3.58 2.15 -1.26 -4.85 116.67 121.75 1s4e s ASP 127 Ca 0.51 2.71 -0.01 0.00 0.43 0.00 0.00 52.55 56.19 1s4e s ASP 127 Cb -0.24 -2.61 0.66 0.00 -0.30 0.00 0.00 42.92 40.43 1s4e s ASP 127 CO 0.30 -0.81 1.58 -0.65 -0.17 0.00 0.00 175.17 175.42 1s4e h PRO 128 N 5.81 0.03 -0.10 4.34 0.11 -1.99 0.23 132.00 140.43 1s4e h PRO 128 Ca -0.45 -0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.53 1s4e h PRO 128 Cb 1.21 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1s4e h PRO 128 CO 0.85 0.02 -0.51 1.25 -0.21 0.00 0.00 178.00 179.40 1s4e h LEU 129 N 0.03 0.29 -0.86 2.35 6.46 -2.00 -2.51 115.31 119.08 1s4e h LEU 129 Ca 0.55 -0.15 -0.08 0.00 -0.12 0.00 0.00 57.88 58.08 1s4e h LEU 129 Cb 1.07 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.91 1s4e h LEU 129 CO -0.89 0.75 -0.38 0.50 -0.62 0.00 0.00 178.44 177.80 1s4e h LYS 130 N 0.21 0.00 0.17 1.25 3.64 -1.37 -2.84 116.57 117.62 1s4e h LYS 130 Ca 0.01 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1s4e h LYS 130 Cb 0.97 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1s4e h LYS 130 CO 0.08 0.38 -0.08 0.87 -2.27 0.00 0.00 179.45 178.43 1s4e h LYS 131 N 0.00 -0.22 -0.73 1.90 1.57 -0.18 -2.16 116.57 116.76 1s4e h LYS 131 Ca -0.00 0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 1s4e h LYS 131 Cb 0.94 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 1s4e h LYS 131 CO 0.05 -0.11 0.22 0.00 -0.57 0.00 0.00 179.45 179.03 1s4e h ALA 132 N 0.57 1.01 -0.38 3.86 0.00 -1.56 -2.36 119.26 120.39 1s4e h ALA 132 Ca -0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1s4e h ALA 132 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1s4e h ALA 132 CO 0.04 0.66 0.01 -0.07 0.00 0.00 0.00 179.25 179.89 1s4e h LEU 133 N 1.09 0.55 -0.00 0.00 3.38 -1.39 -1.71 115.31 117.23 1s4e h LEU 133 Ca 0.23 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1s4e h LEU 133 Cb 0.32 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1s4e h LEU 133 CO -0.01 0.62 -0.03 -0.07 0.09 0.00 0.00 178.44 179.04 1s4e h LEU 134 N 0.57 0.03 -1.18 1.67 3.38 -1.29 -1.89 115.31 116.59 1s4e h LEU 134 Ca 0.12 -0.75 0.11 0.00 0.09 0.00 0.00 57.88 57.45 1s4e h LEU 134 Cb 0.34 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 1s4e h LEU 134 CO 0.01 0.78 0.59 0.00 0.09 0.00 0.00 178.44 179.91 1s4e h ALA 135 N 0.25 1.66 -0.37 1.53 0.00 -1.36 0.78 119.26 121.76 1s4e h ALA 135 Ca -0.00 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1s4e h ALA 135 Cb 0.78 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1s4e h ALA 135 CO 0.01 0.13 0.02 -0.22 0.00 0.00 0.00 179.25 179.18 1s4e h LYS 136 N 0.86 0.63 -0.31 0.00 3.64 -1.33 -2.81 116.57 117.26 1s4e h LYS 136 Ca 0.44 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.63 1s4e h LYS 136 Cb 0.50 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1s4e h LYS 136 CO -0.20 0.73 0.21 0.87 -2.27 0.00 0.00 179.45 178.79 1s4e h LYS 137 N 0.46 0.38 0.16 1.90 1.57 -0.21 -1.95 116.57 118.87 1s4e h LYS 137 Ca 0.11 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1s4e h LYS 137 Cb 0.44 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1s4e h LYS 137 CO 0.02 0.25 -0.08 0.00 -0.57 0.00 0.00 179.45 179.07 1s4e h ALA 138 N 1.81 -0.22 0.00 3.86 0.00 -0.80 -2.39 119.26 121.52 1s4e h ALA 138 Ca 0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1s4e h ALA 138 Cb -0.00 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1s4e h ALA 138 CO -0.03 -0.45 -0.18 1.49 0.00 0.00 0.00 179.25 180.09 1s4e h GLU 139 N -0.57 0.00 0.00 0.00 4.81 -1.23 -2.83 114.58 114.77 1s4e h GLU 139 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1s4e h GLU 139 Cb 0.43 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1s4e h GLU 139 CO 0.04 0.18 -0.71 -0.91 -0.73 0.00 0.00 179.01 176.88 1s4e h ASN 140 N 0.00 0.00 -2.01 1.04 -0.26 -1.33 -2.28 115.58 110.74 1s4e h ASN 140 Ca -0.00 -0.12 -0.51 0.00 -0.56 0.00 0.00 56.30 55.11 1s4e h ASN 140 Cb 0.37 0.00 -0.40 0.00 -1.06 0.00 0.00 38.32 37.23 1s4e h ASN 140 CO 0.02 0.06 -1.16 -0.62 -1.06 0.00 0.00 177.43 174.67 1s4e n GLU 141 N -2.38 0.95 0.00 0.81 1.02 -0.90 -4.58 120.64 115.55 1s4e n GLU 141 Ca 0.02 -3.37 0.00 0.00 -0.02 0.00 0.00 57.16 53.79 1s4e n GLU 141 Cb 0.48 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 1s4e n GLU 141 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1s4e n VAL 143 N 0.59 0.00 -1.80 2.62 0.31 -1.25 -4.98 118.33 113.83 1s4e n VAL 143 Ca 0.24 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.21 1s4e n VAL 143 Cb 0.62 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.55 1s4e n VAL 143 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1s4e n GLY 144 N 0.00 5.14 3.18 2.92 0.00 -1.26 -4.69 105.19 110.49 1s4e n GLY 144 Ca 0.00 -2.28 -0.35 0.00 0.00 0.00 0.00 46.02 43.39 1s4e n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s4e s VAL 145 N -4.05 3.12 0.35 1.61 1.01 -0.86 -5.04 120.40 116.55 1s4e s VAL 145 Ca 0.54 -1.39 -0.25 0.00 0.00 0.00 0.00 61.98 60.88 1s4e s VAL 145 Cb 0.41 -2.81 -0.10 0.00 0.00 0.00 0.00 36.38 33.88 1s4e s VAL 145 CO -0.34 -0.15 0.99 -2.16 0.00 0.00 0.00 175.10 173.44 1s4e s PRO 146 N 1.27 4.42 0.00 2.72 0.04 -1.26 -3.80 135.00 138.38 1s4e s PRO 146 Ca -0.04 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.40 1s4e s PRO 146 Cb -0.20 -2.69 0.00 0.00 0.04 0.00 0.00 34.50 31.65 1s4e s PRO 146 CO -0.01 0.11 0.00 0.00 0.04 0.00 0.00 177.00 177.14 1s4e n GLY 148 N -0.10 -0.25 0.00 0.00 0.00 -1.26 -5.02 105.19 98.56 1s4e n GLY 148 Ca 0.00 -1.65 0.07 0.00 0.00 0.00 0.00 46.02 44.44 1s4e n GLY 148 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1s4e n ILE 149 N 0.00 0.00 -0.14 -0.61 3.06 -1.26 -4.59 119.36 115.82 1s4e n ILE 149 Ca 0.00 -0.19 0.00 0.00 -2.50 0.00 0.00 62.75 60.07 1s4e n ILE 149 Cb 0.00 0.85 0.03 0.00 0.54 0.00 0.00 39.64 41.05 1s4e n ILE 149 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 1s4e n LEU 150 N -1.47 -0.21 0.13 9.51 -0.00 -1.26 -1.64 117.00 122.06 1s4e n LEU 150 Ca 0.02 0.66 -0.07 0.00 -0.00 0.00 0.00 56.01 56.61 1s4e n LEU 150 Cb 0.26 -0.17 -0.04 0.00 -0.00 0.00 0.00 43.42 43.48 1s4e n LEU 150 CO 0.30 -0.60 0.19 0.44 -0.00 0.00 0.00 177.39 177.72 1s4e h ASP 151 N 0.00 -0.36 -0.45 1.96 3.32 -2.01 -2.77 116.42 116.11 1s4e h ASP 151 Ca 0.15 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1s4e h ASP 151 Cb 0.24 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 1s4e h ASP 151 CO -0.38 0.09 0.26 1.56 -1.72 0.00 0.00 179.24 179.05 1s4e h GLN 152 N -1.10 0.65 -0.22 3.56 7.50 -1.85 -2.05 115.11 121.60 1s4e h GLN 152 Ca -0.04 -0.06 -0.19 0.00 0.50 0.00 0.00 58.65 58.85 1s4e h GLN 152 Cb 0.36 -0.13 0.00 0.00 0.05 0.00 0.00 27.48 27.75 1s4e h GLN 152 CO 0.07 0.48 -0.62 0.35 -1.50 0.00 0.00 178.83 177.61 1s4e h PHE 153 N 0.66 0.97 -0.35 2.96 3.57 -1.41 -2.21 116.94 121.13 1s4e h PHE 153 Ca 0.17 -0.37 -0.01 0.00 3.53 0.00 0.00 57.97 61.28 1s4e h PHE 153 Cb 0.02 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 1s4e h PHE 153 CO 0.00 1.18 0.16 0.00 -2.23 0.00 0.00 178.31 177.42 1s4e h ALA 154 N 0.73 0.45 -0.78 2.41 0.00 -1.16 -0.46 119.26 120.45 1s4e h ALA 154 Ca -0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1s4e h ALA 154 Cb 1.22 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1s4e h ALA 154 CO 0.13 0.02 0.48 0.28 0.00 0.00 0.00 179.25 180.16 1s4e h VAL 155 N 0.42 1.22 0.03 0.00 2.07 -1.28 -0.80 116.25 117.91 1s4e h VAL 155 Ca 0.12 -0.45 -0.26 0.00 0.82 0.00 0.00 66.70 66.93 1s4e h VAL 155 Cb 0.14 0.11 0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1s4e h VAL 155 CO -0.01 0.22 -1.02 0.58 0.02 0.00 0.00 177.57 177.36 1s4e h VAL 156 N 1.07 1.31 -0.18 2.57 2.07 -1.34 -3.37 116.25 118.38 1s4e h VAL 156 Ca 0.28 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.53 1s4e h VAL 156 Cb -0.06 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1s4e h VAL 156 CO -0.06 0.69 0.00 0.49 0.02 0.00 0.00 177.57 178.72 1s4e n PHE 157 N -3.90 0.22 -1.67 1.57 3.01 -0.19 -4.44 117.46 112.06 1s4e n PHE 157 Ca -0.12 -0.14 -0.45 0.00 1.01 0.00 0.00 57.45 57.76 1s4e n PHE 157 Cb 0.88 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.32 1s4e n PHE 157 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1s4e n GLY 158 N 1.14 0.71 3.35 1.37 0.00 -0.33 -4.85 105.19 106.59 1s4e n GLY 158 Ca 0.14 0.49 -0.28 0.00 0.00 0.00 0.00 46.02 46.36 1s4e n GLY 158 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s4e s LYS 159 N -0.50 1.47 0.00 1.61 2.20 -0.86 -2.24 119.74 121.42 1s4e s LYS 159 Ca 0.68 -1.22 0.00 0.00 -0.36 0.00 0.00 55.97 55.06 1s4e s LYS 159 Cb -0.66 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 33.85 1s4e s LYS 159 CO 0.51 0.44 0.43 1.17 -0.36 0.00 0.00 175.35 177.54 1s4e n LYS 160 N 1.25 0.00 -1.53 4.03 0.00 -1.21 -2.41 118.16 118.30 1s4e n LYS 160 Ca -0.18 0.43 -0.34 0.00 0.00 0.00 0.00 58.31 58.22 1s4e n LYS 160 Cb 0.53 -0.84 0.05 0.00 0.00 0.00 0.00 35.03 34.76 1s4e n LYS 160 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1s4e n ASP 161 N -1.02 7.42 -3.96 3.14 8.00 -1.26 -2.89 116.55 125.98 1s4e n ASP 161 Ca 0.00 -3.69 -0.09 0.00 0.71 0.00 0.00 54.79 51.72 1s4e n ASP 161 Cb 0.00 -1.05 -0.10 0.00 -0.02 0.00 0.00 41.12 39.95 1s4e n ASP 161 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1s4e s ASN 162 N -1.15 0.21 0.34 -2.24 0.01 -1.01 -1.05 114.94 110.05 1s4e s ASN 162 Ca 0.56 -0.52 0.08 0.00 -0.71 0.00 0.00 52.86 52.27 1s4e s ASN 162 Cb 0.45 0.17 -0.04 0.00 0.41 0.00 0.00 41.25 42.24 1s4e s ASN 162 CO -0.18 -0.42 0.19 0.68 -1.51 0.00 0.00 177.10 175.85 1s4e s VAL 163 N -2.14 3.12 -0.24 1.60 -7.23 -0.32 -4.62 120.40 110.57 1s4e s VAL 163 Ca -0.09 -1.60 -0.00 0.00 -1.81 0.00 0.00 61.98 58.47 1s4e s VAL 163 Cb -0.04 -3.03 0.03 0.00 0.56 0.00 0.00 36.38 33.90 1s4e s VAL 163 CO -0.03 -0.17 -0.09 -0.63 -0.31 0.00 0.00 175.10 173.87 1s4e s ILE 164 N -2.40 2.63 0.06 -0.62 1.01 -0.47 -1.35 121.20 120.06 1s4e s ILE 164 Ca 0.39 -1.15 -0.30 0.00 0.00 0.00 0.00 60.65 59.59 1s4e s ILE 164 Cb -0.03 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 40.04 1s4e s ILE 164 CO 0.24 0.19 1.03 0.12 0.00 0.00 0.00 174.94 176.51 1s4e s PHE 165 N 1.27 3.65 -0.06 3.97 5.36 -0.86 -3.21 117.98 128.11 1s4e s PHE 165 Ca -0.01 1.65 -0.01 0.00 -0.96 0.00 0.00 56.93 57.60 1s4e s PHE 165 Cb -0.17 -3.17 0.03 0.00 -0.34 0.00 0.00 43.02 39.37 1s4e s PHE 165 CO -0.06 -0.24 -0.00 -1.17 -1.46 0.00 0.00 175.22 172.29 1s4e s LEU 166 N 0.60 0.81 -0.43 6.12 0.20 0.02 -2.35 118.68 123.64 1s4e s LEU 166 Ca 0.52 -0.07 -0.23 0.00 0.69 0.00 0.00 54.13 55.04 1s4e s LEU 166 Cb -0.24 -0.39 0.02 0.00 -0.43 0.00 0.00 46.19 45.16 1s4e s LEU 166 CO 0.29 -0.15 0.76 -0.62 -0.29 0.00 0.00 176.35 176.34 1s4e s ASP 167 N 1.61 6.42 0.02 3.68 -1.08 -0.63 -0.91 116.67 125.78 1s4e s ASP 167 Ca -0.01 -0.06 0.23 0.00 -0.52 0.00 0.00 52.55 52.20 1s4e s ASP 167 Cb -0.13 -2.38 0.99 0.00 -1.46 0.00 0.00 42.92 39.94 1s4e s ASP 167 CO -0.03 -0.86 1.75 0.35 0.52 0.00 0.00 175.17 176.90 1s4e n THR 168 N 6.03 0.41 0.11 1.71 -2.24 -0.53 -0.66 114.28 119.11 1s4e n THR 168 Ca 0.02 0.08 -0.24 0.00 -2.27 0.00 0.00 64.05 61.64 1s4e n THR 168 Cb 0.48 -0.71 -0.15 0.00 -2.10 0.00 0.00 70.33 67.85 1s4e n THR 168 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1s4e h GLN 169 N 0.00 0.47 -0.00 -0.78 4.15 -1.77 -3.37 115.11 113.80 1s4e h GLN 169 Ca 0.00 -0.80 0.00 0.00 0.77 0.00 0.00 58.65 58.62 1s4e h GLN 169 Cb 0.42 0.30 0.00 0.00 0.21 0.00 0.00 27.48 28.40 1s4e h GLN 169 CO 0.00 1.38 -0.84 0.25 -1.93 0.00 0.00 178.83 177.70 1s4e n THR 170 N -3.66 0.00 -1.14 2.39 -2.24 -1.19 -4.98 114.28 103.46 1s4e n THR 170 Ca -0.21 -0.08 -0.07 0.00 -2.27 0.00 0.00 64.05 61.41 1s4e n THR 170 Cb 1.09 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 70.30 1s4e n THR 170 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1s4e n LEU 171 N -1.37 0.03 -4.77 3.22 4.77 0.16 -4.99 117.00 114.04 1s4e n LEU 171 Ca 0.04 0.18 -0.38 0.00 -0.03 0.00 0.00 56.01 55.81 1s4e n LEU 171 Cb 0.29 -2.41 -0.03 0.00 -2.33 0.00 0.00 43.42 38.94 1s4e n LEU 171 CO 0.36 -0.92 0.79 -1.58 -1.33 0.00 0.00 177.39 174.71 1s4e s GLN 172 N -2.47 4.20 0.13 3.23 2.00 -1.23 -4.85 119.66 120.67 1s4e s GLN 172 Ca 0.00 1.70 -0.01 0.00 -2.00 0.00 0.00 55.36 55.05 1s4e s GLN 172 Cb 0.00 -2.71 -0.04 0.00 0.80 0.00 0.00 33.01 31.06 1s4e s GLN 172 CO 0.00 -0.16 0.05 1.52 -0.50 0.00 0.00 175.29 176.20 1s4e s TYR 173 N -1.47 0.87 -0.25 1.67 -0.85 -1.26 -1.60 117.35 114.46 1s4e s TYR 173 Ca 0.55 -1.22 -0.10 0.00 -0.52 0.00 0.00 57.07 55.78 1s4e s TYR 173 Cb -0.27 -0.49 0.10 0.00 0.38 0.00 0.00 41.96 41.68 1s4e s TYR 173 CO 0.35 -0.50 0.57 -2.00 -1.52 0.00 0.00 175.55 172.45 1s4e s GLU 174 N -4.04 0.51 0.34 -3.49 2.12 -0.99 -5.01 118.70 108.15 1s4e s GLU 174 Ca 0.23 1.22 -0.26 0.00 0.36 0.00 0.00 54.97 56.52 1s4e s GLU 174 Cb 0.07 0.48 -0.09 0.00 0.26 0.00 0.00 34.13 34.85 1s4e s GLU 174 CO 0.01 -0.20 1.04 0.71 -0.54 0.00 0.00 175.26 176.29 1s4e s TYR 175 N 2.40 3.47 -0.15 5.30 4.12 -1.26 -2.02 117.35 129.21 1s4e s TYR 175 Ca -0.06 1.70 -0.02 0.00 0.02 0.00 0.00 57.07 58.71 1s4e s TYR 175 Cb -0.10 -3.13 0.05 0.00 -1.52 0.00 0.00 41.96 37.25 1s4e s TYR 175 CO -0.17 -0.41 0.03 0.42 0.02 0.00 0.00 175.55 175.44 1s4e s ILE 176 N -1.47 0.42 0.30 2.71 1.01 -0.46 -4.95 121.20 118.76 1s4e s ILE 176 Ca 0.52 -0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.58 1s4e s ILE 176 Cb -0.25 -0.82 -0.12 0.00 0.01 0.00 0.00 42.46 41.29 1s4e s ILE 176 CO 0.31 -0.05 1.58 -2.65 0.00 0.00 0.00 174.94 174.13 1s4e n PRO 177 N 5.10 2.67 -3.88 2.79 -0.02 -1.26 -1.17 135.00 139.23 1s4e n PRO 177 Ca -0.08 0.95 -0.35 0.00 -2.02 0.00 0.00 63.50 61.99 1s4e n PRO 177 Cb 0.48 -2.72 -0.10 0.00 -0.02 0.00 0.00 33.50 31.14 1s4e n PRO 177 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1s4e s PHE 178 N -0.13 3.25 0.22 6.00 5.36 -0.21 -4.83 117.98 127.62 1s4e s PHE 178 Ca 0.63 0.05 -0.32 0.00 -0.96 0.00 0.00 56.93 56.33 1s4e s PHE 178 Cb -0.50 -2.15 -0.13 0.00 -0.34 0.00 0.00 43.02 39.90 1s4e s PHE 178 CO 0.50 0.07 1.56 -0.35 -1.46 0.00 0.00 175.22 175.54 1s4e n PRO 179 N 3.91 2.34 0.22 10.12 -0.04 -1.26 -4.77 135.00 145.52 1s4e n PRO 179 Ca -0.16 0.84 0.08 0.00 -0.04 0.00 0.00 63.50 64.22 1s4e n PRO 179 Cb 0.52 -2.59 0.49 0.00 -0.04 0.00 0.00 33.50 31.87 1s4e n PRO 179 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1s4e h LYS 180 N 5.41 0.00 -0.61 0.54 -0.00 -1.97 -2.56 116.57 117.37 1s4e h LYS 180 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.20 1s4e h LYS 180 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.47 1s4e h LYS 180 CO 0.85 0.26 0.00 -0.40 -0.00 0.00 0.00 179.45 180.16 1s4e n ASP 181 N -3.61 1.98 -3.88 7.07 5.68 -1.26 -4.68 116.55 117.84 1s4e n ASP 181 Ca -0.01 -2.17 -0.27 0.00 -0.50 0.00 0.00 54.79 51.84 1s4e n ASP 181 Cb 0.39 -0.40 -0.17 0.00 -1.14 0.00 0.00 41.12 39.81 1s4e n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1s4e s VAL 182 N -1.61 0.95 0.05 2.12 1.01 -0.97 -2.59 120.40 119.37 1s4e s VAL 182 Ca 0.16 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 1s4e s VAL 182 Cb 0.11 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 1s4e s VAL 182 CO 0.07 0.30 0.29 -0.44 0.00 0.00 0.00 175.10 175.32 1s4e s SER 183 N 1.73 6.48 -0.08 3.32 0.01 -0.72 -4.80 113.70 119.63 1s4e s SER 183 Ca 0.04 0.53 -0.21 0.00 1.31 0.00 0.00 55.95 57.62 1s4e s SER 183 Cb -0.13 -2.07 -0.04 0.00 0.21 0.00 0.00 66.02 63.99 1s4e s SER 183 CO -0.08 0.19 0.59 -0.69 0.41 0.00 0.00 173.24 173.67 1s4e s VAL 184 N -1.41 5.09 -0.34 3.43 1.01 -1.22 -3.07 120.40 123.91 1s4e s VAL 184 Ca 0.32 1.21 -0.12 0.00 0.00 0.00 0.00 61.98 63.39 1s4e s VAL 184 Cb -0.13 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 1s4e s VAL 184 CO 0.20 0.30 0.21 -0.22 0.00 0.00 0.00 175.10 175.59 1s4e s LEU 185 N 0.60 4.41 -0.20 3.92 1.98 -0.51 -2.43 118.68 126.45 1s4e s LEU 185 Ca 0.32 -0.52 -0.10 0.00 -2.89 0.00 0.00 54.13 50.93 1s4e s LEU 185 Cb -0.17 -2.08 -0.05 0.00 0.66 0.00 0.00 46.19 44.55 1s4e s LEU 185 CO 0.15 -0.24 0.13 -0.69 -1.89 0.00 0.00 176.35 173.81 1s4e s VAL 186 N 1.67 5.40 -0.38 1.68 1.01 -0.58 -1.34 120.40 127.87 1s4e s VAL 186 Ca 0.05 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.24 1s4e s VAL 186 Cb -0.17 -3.47 0.12 0.00 0.00 0.00 0.00 36.38 32.85 1s4e s VAL 186 CO 0.09 0.43 0.15 0.12 0.00 0.00 0.00 175.10 175.89 1s4e s PHE 187 N 0.44 2.27 0.06 5.22 5.36 -0.84 -0.23 117.98 130.26 1s4e s PHE 187 Ca 0.08 -2.31 -0.31 0.00 -0.96 0.00 0.00 56.93 53.43 1s4e s PHE 187 Cb -0.11 -2.07 -0.09 0.00 -0.34 0.00 0.00 43.02 40.41 1s4e s PHE 187 CO -0.01 -0.85 1.75 -0.47 -1.46 0.00 0.00 175.22 174.18 1s4e s TYR 188 N 0.89 2.12 0.00 10.12 5.04 0.14 -2.54 117.35 133.12 1s4e s TYR 188 Ca 0.13 0.09 0.22 0.00 -2.44 0.00 0.00 57.07 55.08 1s4e s TYR 188 Cb -0.21 -4.06 0.65 0.00 0.35 0.00 0.00 41.96 38.70 1s4e s TYR 188 CO -0.11 -4.39 1.71 1.79 -1.34 0.00 0.00 175.55 173.21 1s4e h THR 189 N 5.00 0.56 -0.45 4.34 1.35 -1.60 -2.75 112.91 119.37 1s4e h THR 189 Ca -0.44 -1.38 -0.06 0.00 -0.55 0.00 0.00 66.41 63.98 1s4e h THR 189 Cb 1.21 1.95 -0.00 0.00 -1.73 0.00 0.00 68.15 69.58 1s4e h THR 189 CO 0.94 0.26 -0.08 0.61 -0.25 0.00 0.00 175.52 177.00 1s4e n GLY 190 N 0.52 0.24 2.84 5.82 0.00 -1.26 -4.34 105.19 109.00 1s4e n GLY 190 Ca 0.01 -0.76 -0.27 0.00 0.00 0.00 0.00 46.02 45.01 1s4e n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s4e s VAL 191 N -2.16 0.82 -0.17 1.61 1.01 -1.26 -4.39 120.40 115.85 1s4e s VAL 191 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1s4e s VAL 191 Cb -0.00 -1.03 0.04 0.00 0.00 0.00 0.00 36.38 35.39 1s4e s VAL 191 CO 0.00 0.13 -0.08 -0.54 0.00 0.00 0.00 175.10 174.61 1s4e s LYS 192 N 1.77 1.71 0.11 2.72 1.02 -1.26 -1.43 119.74 124.37 1s4e s LYS 192 Ca 0.02 -0.61 -0.06 0.00 0.02 0.00 0.00 55.97 55.34 1s4e s LYS 192 Cb -0.14 -2.12 -0.06 0.00 -0.52 0.00 0.00 37.83 34.99 1s4e s LYS 192 CO -0.07 -0.40 0.37 0.50 -0.92 0.00 0.00 175.35 174.82 1s4e s ARG 193 N 1.55 3.65 0.27 1.68 3.52 -1.26 -5.00 118.95 123.35 1s4e s ARG 193 Ca 0.01 -0.03 -0.03 0.00 -0.13 0.00 0.00 55.73 55.55 1s4e s ARG 193 Cb -0.15 -2.91 0.57 0.00 -1.56 0.00 0.00 34.95 30.89 1s4e s ARG 193 CO -0.08 0.51 1.63 0.93 -0.81 0.00 0.00 175.30 177.48 1s4e h GLU 194 N 3.17 0.12 0.00 5.12 3.07 -2.01 -2.67 114.58 121.38 1s4e h GLU 194 Ca -0.47 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 1s4e h GLU 194 Cb 1.18 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.06 1s4e h GLU 194 CO 0.70 0.08 0.00 1.28 -1.40 0.00 0.00 179.01 179.67 1s4e n LEU 195 N -5.33 0.00 -0.17 1.33 4.77 -1.26 -4.09 117.00 112.25 1s4e n LEU 195 Ca 0.17 0.27 -0.08 0.00 -0.03 0.00 0.00 56.01 56.35 1s4e n LEU 195 Cb 0.58 -0.27 0.01 0.00 -2.33 0.00 0.00 43.42 41.40 1s4e n LEU 195 CO 0.03 -0.09 0.97 0.00 -1.33 0.00 0.00 177.39 176.97 1s4e h ALA 196 N 2.95 0.63 -0.39 -1.18 0.00 -1.83 -1.51 119.26 117.92 1s4e h ALA 196 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1s4e h ALA 196 Cb 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1s4e h ALA 196 CO 0.00 0.21 -0.23 1.03 0.00 0.00 0.00 179.25 180.26 1s4e h SER 197 N 0.64 0.79 0.98 0.00 0.87 -1.81 -2.19 113.55 112.82 1s4e h SER 197 Ca 0.16 -0.29 -0.10 0.00 -1.23 0.00 0.00 61.79 60.33 1s4e h SER 197 Cb 0.15 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 1s4e h SER 197 CO -0.02 0.99 -1.08 0.77 -0.53 0.00 0.00 176.83 176.97 1s4e h SER 198 N 0.67 0.00 -0.22 6.23 4.64 -1.80 -2.54 113.55 120.54 1s4e h SER 198 Ca 0.09 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.34 1s4e h SER 198 Cb 0.75 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1s4e h SER 198 CO 0.06 0.38 -0.16 -0.33 -0.87 0.00 0.00 176.83 175.91 1s4e h GLU 199 N 0.00 0.49 -0.15 4.77 4.39 -1.20 -2.17 114.58 120.71 1s4e h GLU 199 Ca -0.09 -0.24 0.04 0.00 0.34 0.00 0.00 59.36 59.42 1s4e h GLU 199 Cb 1.37 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.97 1s4e h GLU 199 CO 0.03 0.80 -0.14 -0.92 -1.16 0.00 0.00 179.01 177.62 1s4e h TYR 200 N 0.18 -0.36 -0.98 4.33 3.20 -1.47 -1.57 116.97 120.30 1s4e h TYR 200 Ca 0.04 0.02 0.18 0.00 3.14 0.00 0.00 58.73 62.12 1s4e h TYR 200 Cb 0.68 0.19 -0.10 0.00 1.54 0.00 0.00 36.73 39.03 1s4e h TYR 200 CO 0.07 -0.21 0.58 0.00 -1.64 0.00 0.00 178.16 176.96 1s4e h ALA 201 N 0.92 1.60 -0.10 1.82 0.00 -1.40 -0.20 119.26 121.90 1s4e h ALA 201 Ca 0.10 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 1s4e h ALA 201 Cb 0.31 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1s4e h ALA 201 CO -0.25 -0.05 -0.49 1.49 0.00 0.00 0.00 179.25 179.95 1s4e h GLU 202 N 0.75 0.50 -0.41 0.00 4.57 -0.75 -0.68 114.58 118.56 1s4e h GLU 202 Ca 0.56 -0.41 0.08 0.00 -1.18 0.00 0.00 59.36 58.41 1s4e h GLU 202 Cb 0.85 0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 29.44 1s4e h GLU 202 CO -0.38 1.04 -0.10 0.00 -1.18 0.00 0.00 179.01 178.39 1s4e h ARG 203 N 0.09 -0.00 -0.20 1.92 2.47 -0.67 0.79 114.38 118.79 1s4e h ARG 203 Ca -0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1s4e h ARG 203 Cb 1.13 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.44 1s4e h ARG 203 CO 0.10 -0.00 0.13 -0.22 0.56 0.00 0.00 179.97 180.54 1s4e h LYS 204 N -0.00 0.26 -0.28 0.04 3.64 -0.76 -0.66 116.57 118.81 1s4e h LYS 204 Ca 0.20 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1s4e h LYS 204 Cb 0.30 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1s4e h LYS 204 CO -0.43 0.18 0.18 -0.09 -2.27 0.00 0.00 179.45 177.02 1s4e h ARG 205 N 0.26 0.37 -0.59 1.90 2.43 -0.78 -1.63 114.38 116.35 1s4e h ARG 205 Ca 0.07 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1s4e h ARG 205 Cb -0.03 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1s4e h ARG 205 CO -0.02 0.26 0.29 0.82 -1.51 0.00 0.00 179.97 179.81 1s4e h ILE 206 N 0.38 1.19 0.08 1.20 2.04 -0.44 -0.51 117.51 121.45 1s4e h ILE 206 Ca 0.10 -0.53 -0.29 0.00 1.00 0.00 0.00 64.86 65.14 1s4e h ILE 206 Cb -0.03 0.43 0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1s4e h ILE 206 CO -0.02 0.22 -1.17 0.00 0.00 0.00 0.00 178.15 177.18 1s4e h ALA 207 N 1.49 0.04 -0.51 1.87 0.00 -0.87 -2.00 119.26 119.29 1s4e h ALA 207 Ca 0.21 -0.75 0.10 0.00 0.00 0.00 0.00 54.91 54.47 1s4e h ALA 207 Cb 0.08 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1s4e h ALA 207 CO -0.03 0.69 0.01 0.93 0.00 0.00 0.00 179.25 180.85 1s4e h GLU 208 N 0.33 0.12 -0.67 0.00 5.08 -1.16 -1.09 114.58 117.19 1s4e h GLU 208 Ca -0.17 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1s4e h GLU 208 Cb 1.84 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 31.03 1s4e h GLU 208 CO 0.23 0.08 0.36 1.49 -1.00 0.00 0.00 179.01 180.17 1s4e h GLU 209 N 0.13 0.93 -0.31 2.33 4.81 -1.05 -2.06 114.58 119.36 1s4e h GLU 209 Ca 0.26 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1s4e h GLU 209 Cb 0.39 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1s4e h GLU 209 CO -0.42 0.70 0.02 0.77 -0.73 0.00 0.00 179.01 179.36 1s4e h SER 210 N 0.91 0.53 -0.89 1.04 0.02 -0.82 -0.60 113.55 113.73 1s4e h SER 210 Ca 0.23 -0.29 0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1s4e h SER 210 Cb 0.04 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.40 1s4e h SER 210 CO -0.04 0.68 0.59 -0.07 -1.14 0.00 0.00 176.83 176.86 1s4e h LEU 211 N 0.35 0.99 -0.51 5.07 3.38 -0.98 -1.22 115.31 122.40 1s4e h LEU 211 Ca 0.09 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 1s4e h LEU 211 Cb 0.40 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1s4e h LEU 211 CO 0.01 0.69 -0.61 -0.09 0.09 0.00 0.00 178.44 178.53 1s4e h ARG 212 N 1.15 0.46 -0.16 1.13 2.43 -1.05 0.32 114.38 118.67 1s4e h ARG 212 Ca 0.34 -0.32 -0.16 0.00 -0.81 0.00 0.00 59.98 59.03 1s4e h ARG 212 Cb -0.04 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1s4e h ARG 212 CO -0.09 0.93 -0.57 0.82 -1.51 0.00 0.00 179.97 179.55 1s4e h ILE 213 N 0.34 1.33 0.00 1.20 2.04 -0.27 -3.02 117.51 119.13 1s4e h ILE 213 Ca -0.01 -1.84 0.00 0.00 1.00 0.00 0.00 64.86 64.01 1s4e h ILE 213 Cb 1.16 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 39.06 1s4e h ILE 213 CO 0.11 0.57 -0.04 -0.07 0.00 0.00 0.00 178.15 178.72 1s4e h LEU 214 N 0.39 0.00 0.15 1.44 3.38 -1.14 -3.48 115.31 116.05 1s4e h LEU 214 Ca 0.00 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1s4e h LEU 214 Cb 1.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1s4e h LEU 214 CO 0.10 0.00 -0.05 0.61 0.09 0.00 0.00 178.44 179.20 1s4e n GLY 215 N 1.13 0.34 3.41 0.83 0.00 -0.06 -5.04 105.19 105.79 1s4e n GLY 215 Ca 0.04 -0.79 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 1s4e n GLY 215 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s4e s LYS 216 N -4.18 1.49 0.00 1.61 1.02 -0.26 -5.04 119.74 114.38 1s4e s LYS 216 Ca 0.00 -1.60 0.14 0.00 0.02 0.00 0.00 55.97 54.53 1s4e s LYS 216 Cb -0.00 -1.57 -0.15 0.00 -0.52 0.00 0.00 37.83 35.58 1s4e s LYS 216 CO 0.01 0.31 0.59 0.39 -0.92 0.00 0.00 175.35 175.72 1s4e n GLU 217 N -0.16 2.43 -3.66 1.68 1.02 -1.26 -4.46 120.64 116.23 1s4e n GLU 217 Ca -0.09 -0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.90 1s4e n GLU 217 Cb 0.58 -1.15 -0.08 0.00 -0.02 0.00 0.00 31.44 30.77 1s4e n GLU 217 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1s4e s SER 218 N -2.30 -0.48 0.58 1.62 0.15 -1.26 -4.78 113.70 107.22 1s4e s SER 218 Ca 0.05 0.67 0.36 0.00 0.70 0.00 0.00 55.95 57.73 1s4e s SER 218 Cb 0.10 0.68 1.72 0.00 -1.71 0.00 0.00 66.02 66.81 1s4e s SER 218 CO 0.57 -0.40 2.12 0.77 1.20 0.00 0.00 173.24 177.50 1s4e h SER 219 N 4.12 0.00 0.09 5.45 4.64 -0.92 -1.96 113.55 124.97 1s4e h SER 219 Ca -0.28 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 1s4e h SER 219 Cb 1.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1s4e h SER 219 CO 0.31 0.03 -0.06 0.11 -0.87 0.00 0.00 176.83 176.35 1s4e h LYS 220 N 0.00 0.00 0.00 4.77 1.57 -1.80 -2.46 116.57 118.65 1s4e h LYS 220 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1s4e h LYS 220 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1s4e h LYS 220 CO 0.00 0.06 -0.08 0.93 -0.57 0.00 0.00 179.45 179.79 1s4e h GLU 221 N 0.00 0.00 -6.67 3.15 5.08 -1.74 -3.46 114.58 110.93 1s4e h GLU 221 Ca -0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 1s4e h GLU 221 Cb 0.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1s4e h GLU 221 CO 0.01 0.00 0.39 0.08 -1.00 0.00 0.00 179.01 178.49 1s4e s VAL 222 N -3.21 4.12 0.37 3.13 1.01 -0.93 -5.03 120.40 119.87 1s4e s VAL 222 Ca 0.07 1.93 0.06 0.00 0.00 0.00 0.00 61.98 64.04 1s4e s VAL 222 Cb 0.06 -4.23 -0.07 0.00 0.00 0.00 0.00 36.38 32.14 1s4e s VAL 222 CO 0.67 0.38 0.01 0.28 0.00 0.00 0.00 175.10 176.43 1s4e s THR 223 N -0.57 1.81 0.09 3.92 -1.32 -1.26 -5.01 115.64 113.30 1s4e s THR 223 Ca 0.45 -2.03 -0.15 0.00 -1.21 0.00 0.00 61.69 58.75 1s4e s THR 223 Cb -0.26 -2.88 -0.11 0.00 -1.51 0.00 0.00 72.50 67.74 1s4e s THR 223 CO 0.33 -0.04 1.37 -0.08 -2.21 0.00 0.00 174.62 173.99 1s4e h GLU 224 N 1.91 0.68 -0.51 7.08 4.57 -1.99 -1.46 114.58 124.85 1s4e h GLU 224 Ca -0.43 -0.41 -0.00 0.00 -1.18 0.00 0.00 59.36 57.34 1s4e h GLU 224 Cb 1.24 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.85 1s4e h GLU 224 CO 0.76 1.03 0.32 -0.22 -1.18 0.00 0.00 179.01 179.72 1s4e h LYS 225 N 0.40 0.69 -0.13 1.92 3.64 -2.00 -2.31 116.57 118.78 1s4e h LYS 225 Ca 0.02 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1s4e h LYS 225 Cb 0.97 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 1s4e h LYS 225 CO 0.09 0.47 0.05 -0.44 -2.27 0.00 0.00 179.45 177.35 1s4e h ASP 226 N 0.70 0.07 -0.72 4.20 3.32 -1.90 -2.82 116.42 119.29 1s4e h ASP 226 Ca 0.19 0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.31 1s4e h ASP 226 Cb -0.04 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 1s4e h ASP 226 CO -0.04 0.06 0.47 -0.07 -1.72 0.00 0.00 179.24 177.95 1s4e h LEU 227 N 0.12 0.65 -1.30 1.55 3.38 -0.73 0.10 115.31 119.10 1s4e h LEU 227 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1s4e h LEU 227 Cb 0.02 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1s4e h LEU 227 CO -0.04 0.42 0.00 1.23 0.09 0.00 0.00 178.44 180.14 1s4e h GLY 228 N 0.74 0.00 1.80 0.83 0.00 -1.21 -2.57 103.07 102.67 1s4e h GLY 228 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1s4e h GLY 228 CO -0.10 0.00 -0.18 0.50 0.00 0.00 0.00 176.54 176.76 1s4e h LYS 229 N 0.00 0.00 -7.12 4.80 1.57 -0.76 -3.46 116.57 111.59 1s4e h LYS 229 Ca 0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 1s4e h LYS 229 Cb 0.31 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.63 1s4e h LYS 229 CO 0.00 0.00 0.33 -0.51 -0.57 0.00 0.00 179.45 178.70 1s4e s LEU 230 N -5.36 3.67 0.96 2.94 1.43 -0.97 -5.06 118.68 116.29 1s4e s LEU 230 Ca 0.07 1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 54.55 1s4e s LEU 230 Cb 0.09 -4.42 0.17 0.00 0.03 0.00 0.00 46.19 42.05 1s4e s LEU 230 CO 0.66 -0.54 1.09 -2.84 0.23 0.00 0.00 176.35 174.95 1s4e s PRO 231 N -3.99 0.74 0.13 1.29 0.02 -1.26 -4.63 135.00 127.30 1s4e s PRO 231 Ca 0.58 0.80 -0.27 0.00 0.02 0.00 0.00 61.00 62.13 1s4e s PRO 231 Cb -0.10 -1.75 -0.04 0.00 0.02 0.00 0.00 34.50 32.63 1s4e s PRO 231 CO 0.30 -2.59 1.60 -1.35 -0.33 0.00 0.00 177.00 174.63 1s4e h PRO 232 N -1.81 -0.43 -0.41 5.54 0.11 -1.97 0.17 132.00 133.20 1s4e h PRO 232 Ca -0.52 0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.52 1s4e h PRO 232 Cb 1.30 0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.50 1s4e h PRO 232 CO 0.54 -0.29 -0.13 1.25 -0.21 0.00 0.00 178.00 179.16 1s4e h LEU 233 N -0.45 0.82 -0.59 2.35 5.85 -2.00 -1.41 115.31 119.89 1s4e h LEU 233 Ca 0.08 -0.38 0.08 0.00 0.84 0.00 0.00 57.88 58.50 1s4e h LEU 233 Cb 0.59 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 1s4e h LEU 233 CO -0.37 1.01 0.25 0.45 -0.34 0.00 0.00 178.44 179.45 1s4e h HIS 234 N 0.62 0.45 -0.54 1.25 3.86 -1.88 -2.03 115.15 116.87 1s4e h HIS 234 Ca 0.10 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.35 1s4e h HIS 234 Cb 0.67 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.99 1s4e h HIS 234 CO 0.05 0.17 0.35 -0.09 0.86 0.00 0.00 177.93 179.27 1s4e h ARG 235 N 0.47 0.69 -0.39 2.45 1.12 -0.21 -1.24 114.38 117.27 1s4e h ARG 235 Ca 0.28 -0.04 -0.00 0.00 -1.11 0.00 0.00 59.98 59.11 1s4e h ARG 235 Cb 0.28 -0.15 -0.02 0.00 -0.01 0.00 0.00 29.97 30.07 1s4e h ARG 235 CO -0.25 0.45 0.23 -0.22 -3.11 0.00 0.00 179.97 177.07 1s4e h LYS 236 N 0.71 0.53 0.07 0.20 3.64 -0.75 -1.42 116.57 119.55 1s4e h LYS 236 Ca 0.21 -0.05 -0.28 0.00 -1.27 0.00 0.00 60.65 59.25 1s4e h LYS 236 Cb -0.05 -0.11 0.03 0.00 -0.41 0.00 0.00 32.23 31.69 1s4e h LYS 236 CO -0.06 0.41 -1.15 0.74 -2.27 0.00 0.00 179.45 177.12 1s4e h PHE 237 N 0.51 1.02 0.00 1.91 0.05 -1.19 -3.13 116.94 116.11 1s4e h PHE 237 Ca 0.14 -0.60 -0.14 0.00 3.82 0.00 0.00 57.97 61.18 1s4e h PHE 237 Cb 0.02 -0.09 -0.02 0.00 2.00 0.00 0.00 35.95 37.86 1s4e h PHE 237 CO -0.03 1.44 -0.67 0.35 -0.18 0.00 0.00 178.31 179.22 1s4e h PHE 238 N 0.30 0.00 -0.47 -0.55 3.57 -1.20 -2.58 116.94 116.01 1s4e h PHE 238 Ca -0.16 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.29 1s4e h PHE 238 Cb 1.82 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.53 1s4e h PHE 238 CO 0.11 0.67 0.09 0.77 -2.23 0.00 0.00 178.31 177.73 1s4e h SER 239 N 0.00 0.67 -0.41 0.41 0.02 -1.26 -1.93 113.55 111.06 1s4e h SER 239 Ca -0.01 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1s4e h SER 239 Cb 1.33 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 1s4e h SER 239 CO 0.09 0.68 0.25 0.22 -1.14 0.00 0.00 176.83 176.93 1s4e h TYR 240 N 0.70 0.53 -0.74 3.45 3.20 -1.41 -2.03 116.97 120.66 1s4e h TYR 240 Ca 0.15 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.07 1s4e h TYR 240 Cb 0.29 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 1s4e h TYR 240 CO 0.01 0.37 0.49 0.82 -1.64 0.00 0.00 178.16 178.21 1s4e h ILE 241 N 0.54 1.09 -0.20 1.81 2.04 -1.16 0.16 117.51 121.79 1s4e h ILE 241 Ca 0.15 -0.30 -0.13 0.00 1.00 0.00 0.00 64.86 65.58 1s4e h ILE 241 Cb -0.02 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.20 1s4e h ILE 241 CO -0.03 0.16 -0.37 0.58 0.00 0.00 0.00 178.15 178.49 1s4e h VAL 242 N 0.87 1.33 -0.10 1.67 2.07 -1.12 -2.09 116.25 118.87 1s4e h VAL 242 Ca 0.30 -1.59 -0.04 0.00 0.82 0.00 0.00 66.70 66.18 1s4e h VAL 242 Cb 0.11 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1s4e h VAL 242 CO -0.09 0.49 -0.14 0.03 0.02 0.00 0.00 177.57 177.88 1s4e h ARG 243 N 0.29 0.16 -0.21 1.57 3.08 -0.82 -2.68 114.38 115.78 1s4e h ARG 243 Ca 0.01 -0.03 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 1s4e h ARG 243 Cb 0.97 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 1s4e h ARG 243 CO 0.08 0.31 -0.52 0.93 -1.07 0.00 0.00 179.97 179.70 1s4e h GLU 244 N 0.15 0.59 -0.77 0.04 4.39 -0.29 -2.39 114.58 116.30 1s4e h GLU 244 Ca 0.03 -0.36 -0.01 0.00 0.34 0.00 0.00 59.36 59.37 1s4e h GLU 244 Cb 0.35 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.00 1s4e h GLU 244 CO 0.02 0.97 0.46 -0.91 -1.16 0.00 0.00 179.01 178.39 1s4e h ASN 245 N 0.46 0.94 0.24 1.42 2.35 -1.18 -0.07 115.58 119.75 1s4e h ASN 245 Ca 0.02 -0.07 -0.10 0.00 -0.55 0.00 0.00 56.30 55.59 1s4e h ASN 245 Cb 1.06 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 1s4e h ASN 245 CO 0.10 0.73 -0.40 0.00 -1.65 0.00 0.00 177.43 176.21 1s4e h ALA 246 N 1.24 1.14 -0.29 -0.83 0.00 -1.46 -2.35 119.26 116.71 1s4e h ALA 246 Ca 0.28 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.62 1s4e h ALA 246 Cb -0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1s4e h ALA 246 CO -0.05 0.58 -0.48 0.00 0.00 0.00 0.00 179.25 179.29 1s4e h ARG 247 N 0.18 0.79 0.06 0.00 3.08 -0.81 -1.88 114.38 115.80 1s4e h ARG 247 Ca 0.02 -0.46 -0.00 0.00 0.07 0.00 0.00 59.98 59.60 1s4e h ARG 247 Cb 0.80 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1s4e h ARG 247 CO 0.06 1.09 -0.03 0.28 -1.07 0.00 0.00 179.97 180.31 1s4e h VAL 248 N 0.62 0.95 -0.90 2.04 2.07 -0.77 0.82 116.25 121.08 1s4e h VAL 248 Ca 0.03 -0.03 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1s4e h VAL 248 Cb 1.06 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 31.73 1s4e h VAL 248 CO 0.11 0.01 0.58 -0.07 0.02 0.00 0.00 177.57 178.21 1s4e h LEU 249 N -0.09 0.77 -0.14 2.57 3.38 -1.33 -1.81 115.31 118.66 1s4e h LEU 249 Ca -0.01 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1s4e h LEU 249 Cb 0.07 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1s4e h LEU 249 CO 0.01 0.43 -0.13 -0.33 0.09 0.00 0.00 178.44 178.51 1s4e h GLU 250 N 0.84 0.33 -0.68 1.13 4.39 -0.78 -2.43 114.58 117.38 1s4e h GLU 250 Ca 0.43 -0.17 0.13 0.00 0.34 0.00 0.00 59.36 60.08 1s4e h GLU 250 Cb 0.50 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.11 1s4e h GLU 250 CO -0.20 0.72 0.46 0.28 -1.16 0.00 0.00 179.01 179.12 1s4e h VAL 251 N -0.05 0.84 -0.10 3.13 2.07 -0.47 -1.57 116.25 120.10 1s4e h VAL 251 Ca 0.02 -0.14 -0.10 0.00 0.82 0.00 0.00 66.70 67.30 1s4e h VAL 251 Cb 0.66 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1s4e h VAL 251 CO 0.03 0.07 -0.33 -0.09 0.02 0.00 0.00 177.57 177.28 1s4e h ARG 252 N 0.40 0.40 -0.81 1.57 2.43 -1.17 -0.56 114.38 116.63 1s4e h ARG 252 Ca 0.33 -0.30 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1s4e h ARG 252 Cb 0.72 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.28 1s4e h ARG 252 CO -0.10 0.92 0.54 -0.44 -1.51 0.00 0.00 179.97 179.38 1s4e h ASP 253 N -0.04 0.88 0.51 -3.80 3.32 -1.18 -2.54 116.42 113.56 1s4e h ASP 253 Ca -0.01 -0.01 -0.20 0.00 0.02 0.00 0.00 57.03 56.82 1s4e h ASP 253 Cb 0.96 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 1s4e h ASP 253 CO 0.07 0.62 -0.88 0.00 -1.72 0.00 0.00 179.24 177.32 1s4e h ALA 254 N 1.52 0.49 -0.05 3.45 0.00 -1.19 -3.08 119.26 120.40 1s4e h ALA 254 Ca 0.32 -0.71 -0.18 0.00 0.00 0.00 0.00 54.91 54.33 1s4e h ALA 254 Cb -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1s4e h ALA 254 CO -0.09 0.88 -0.75 -0.07 0.00 0.00 0.00 179.25 179.22 1s4e h LEU 255 N 0.15 0.40 0.00 0.00 3.38 -1.01 0.17 115.31 118.39 1s4e h LEU 255 Ca -0.05 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1s4e h LEU 255 Cb 1.51 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1s4e h LEU 255 CO 0.14 1.01 0.00 0.29 0.09 0.00 0.00 178.44 179.97 1s4e n LYS 256 N -3.80 0.24 0.00 1.13 5.02 -0.96 -1.68 118.16 118.10 1s4e n LYS 256 Ca -0.04 0.09 0.08 0.00 -2.02 0.00 0.00 58.31 56.42 1s4e n LYS 256 Cb 0.72 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.22 1s4e n LYS 256 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1s4e n GLU 257 N -1.34 1.72 -1.49 1.97 4.71 -1.10 -4.98 120.64 120.14 1s4e n GLU 257 Ca 0.09 -0.74 -0.07 0.00 -0.01 0.00 0.00 57.16 56.43 1s4e n GLU 257 Cb 0.19 -1.26 -0.02 0.00 -1.01 0.00 0.00 31.44 29.34 1s4e n GLU 257 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1s4e n GLY 258 N 1.15 0.68 2.93 0.62 0.00 -0.68 -4.95 105.19 104.93 1s4e n GLY 258 Ca 0.06 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 1s4e n GLY 258 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1s4e n ASP 259 N 0.76 5.00 0.04 1.61 -0.08 0.02 -4.80 116.55 119.10 1s4e n ASP 259 Ca -0.08 -3.07 0.01 0.00 -1.51 0.00 0.00 54.79 50.14 1s4e n ASP 259 Cb 0.34 -1.51 0.33 0.00 2.34 0.00 0.00 41.12 42.62 1s4e n ASP 259 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1s4e h ILE 260 N 3.88 1.19 -0.46 5.18 6.09 -1.93 -2.10 117.51 129.37 1s4e h ILE 260 Ca 0.40 -0.78 0.09 0.00 -1.37 0.00 0.00 64.86 63.20 1s4e h ILE 260 Cb 0.66 1.04 -0.08 0.00 0.47 0.00 0.00 36.82 38.90 1s4e h ILE 260 CO 1.61 0.26 -0.08 -0.33 -3.07 0.00 0.00 178.15 176.54 1s4e h GLU 261 N 0.41 0.03 -0.49 2.19 5.08 -1.93 -1.46 114.58 118.41 1s4e h GLU 261 Ca 0.09 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 1s4e h GLU 261 Cb 0.35 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1s4e h GLU 261 CO 0.01 0.02 -0.17 -0.22 -1.00 0.00 0.00 179.01 177.66 1s4e h LYS 262 N 0.03 0.99 -0.08 2.33 3.64 -1.78 -2.19 116.57 119.51 1s4e h LYS 262 Ca 0.22 -0.40 0.02 0.00 -1.27 0.00 0.00 60.65 59.22 1s4e h LYS 262 Cb 0.34 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1s4e h LYS 262 CO -0.44 1.08 -0.03 0.28 -2.27 0.00 0.00 179.45 178.06 1s4e h VAL 263 N 0.84 0.89 -0.31 2.00 2.07 -1.29 -1.99 116.25 118.47 1s4e h VAL 263 Ca 0.12 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.62 1s4e h VAL 263 Cb 0.74 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1s4e h VAL 263 CO 0.06 0.00 0.09 1.23 0.02 0.00 0.00 177.57 178.97 1s4e h GLY 264 N -0.02 0.47 1.66 2.17 0.00 -1.21 -1.18 103.07 104.95 1s4e h GLY 264 Ca 0.04 -0.22 -0.12 0.00 0.00 0.00 0.00 47.33 47.03 1s4e h GLY 264 CO -0.09 0.21 -0.40 0.07 0.00 0.00 0.00 176.54 176.33 1s4e h LYS 265 N 0.43 0.38 -0.15 4.80 2.10 -1.03 -2.60 116.57 120.51 1s4e h LYS 265 Ca 0.11 -0.18 -0.21 0.00 -2.00 0.00 0.00 60.65 58.36 1s4e h LYS 265 Cb 0.14 -0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.48 1s4e h LYS 265 CO -0.01 0.72 -0.74 0.82 -2.00 0.00 0.00 179.45 178.25 1s4e h ILE 266 N 0.32 1.29 -0.77 0.07 2.04 -0.58 -2.47 117.51 117.41 1s4e h ILE 266 Ca 0.03 -1.95 0.07 0.00 1.00 0.00 0.00 64.86 64.01 1s4e h ILE 266 Cb 0.85 2.02 -0.06 0.00 -0.74 0.00 0.00 36.82 38.88 1s4e h ILE 266 CO 0.07 0.61 0.44 -0.07 0.00 0.00 0.00 178.15 179.21 1s4e h LEU 267 N 0.48 0.66 -0.25 1.44 3.38 -1.21 -0.80 115.31 119.01 1s4e h LEU 267 Ca -0.05 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1s4e h LEU 267 Cb 1.37 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1s4e h LEU 267 CO 0.15 0.41 0.12 0.74 0.09 0.00 0.00 178.44 179.96 1s4e h THR 268 N 0.79 1.14 0.32 0.22 2.02 -1.30 0.78 112.91 116.89 1s4e h THR 268 Ca 0.35 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1s4e h THR 268 Cb 0.24 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1s4e h THR 268 CO -0.20 0.14 -0.24 0.74 0.37 0.00 0.00 175.52 176.33 1s4e h THR 269 N 0.28 0.48 -0.97 3.16 2.02 -1.15 -2.16 112.91 114.57 1s4e h THR 269 Ca 0.09 0.00 0.30 0.00 0.77 0.00 0.00 66.41 67.57 1s4e h THR 269 Cb 0.12 0.48 -0.15 0.00 -1.74 0.00 0.00 68.15 66.86 1s4e h THR 269 CO -0.01 0.00 0.46 0.00 0.37 0.00 0.00 175.52 176.34 1s4e h ALA 270 N 0.05 1.76 0.18 6.16 0.00 -0.79 -1.33 119.26 125.29 1s4e h ALA 270 Ca -0.02 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1s4e h ALA 270 Cb 0.49 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1s4e h ALA 270 CO -0.00 -0.56 -0.09 1.25 0.00 0.00 0.00 179.25 179.85 1s4e h HIS 271 N 0.27 -0.22 0.00 0.00 2.76 -0.21 -1.23 115.15 116.52 1s4e h HIS 271 Ca 0.69 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.85 1s4e h HIS 271 Cb 1.54 0.07 0.00 0.00 1.55 0.00 0.00 27.41 30.57 1s4e h HIS 271 CO -0.09 -0.02 0.00 -1.49 -1.30 0.00 0.00 177.93 175.03 1s4e h TRP 272 N -0.39 0.00 0.15 5.26 4.06 -0.99 -0.03 115.95 124.01 1s4e h TRP 272 Ca -0.02 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.66 1s4e h TRP 272 Cb 0.31 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.48 1s4e h TRP 272 CO -0.02 0.00 -1.30 0.22 -3.56 0.00 0.00 178.44 173.79 1s4e h ASP 273 N 0.00 0.51 -0.92 -3.49 1.82 -0.91 -0.99 116.42 112.44 1s4e h ASP 273 Ca 0.00 -0.90 0.03 0.00 -0.39 0.00 0.00 57.03 55.77 1s4e h ASP 273 Cb 0.29 -0.17 -0.05 0.00 0.68 0.00 0.00 39.33 40.08 1s4e h ASP 273 CO 0.00 1.59 0.60 -0.07 -1.61 0.00 0.00 179.24 179.75 1s4e h LEU 274 N -0.20 1.00 0.09 2.28 3.38 -0.84 -1.62 115.31 119.40 1s4e h LEU 274 Ca -0.26 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1s4e h LEU 274 Cb 1.83 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.36 1s4e h LEU 274 CO 0.13 0.69 -0.04 0.00 0.09 0.00 0.00 178.44 179.31 1s4e h ALA 275 N 1.38 -0.12 0.21 1.53 0.00 -0.99 0.09 119.26 121.36 1s4e h ALA 275 Ca 0.37 -0.21 -0.31 0.00 0.00 0.00 0.00 54.91 54.76 1s4e h ALA 275 Cb -0.00 0.04 0.03 0.00 0.00 0.00 0.00 17.79 17.87 1s4e h ALA 275 CO -0.12 -0.34 -1.33 0.93 0.00 0.00 0.00 179.25 178.39 1s4e h GLU 276 N -0.56 0.53 0.00 0.00 4.39 -1.23 -3.31 114.58 114.39 1s4e h GLU 276 Ca -0.01 -0.85 -0.37 0.00 0.34 0.00 0.00 59.36 58.47 1s4e h GLU 276 Cb 0.47 0.31 -0.06 0.00 -0.10 0.00 0.00 28.75 29.37 1s4e h GLU 276 CO 0.02 1.40 -2.25 0.09 -1.16 0.00 0.00 179.01 177.11 1s4e n ASN 277 N -3.80 1.72 0.09 1.42 3.02 -0.63 -4.42 115.26 112.66 1s4e n ASN 277 Ca -0.16 0.21 0.13 0.00 -0.03 0.00 0.00 54.58 54.73 1s4e n ASN 277 Cb 1.04 -0.61 0.39 0.00 -0.61 0.00 0.00 39.78 39.99 1s4e n ASN 277 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s4e n TYR 278 N -3.86 0.82 -3.68 3.10 9.36 -1.05 -4.67 117.16 117.19 1s4e n TYR 278 Ca -0.43 0.24 -0.21 0.00 3.32 0.00 0.00 57.90 60.81 1s4e n TYR 278 Cb 0.83 -0.87 0.04 0.00 -0.63 0.00 0.00 39.34 38.71 1s4e n TYR 278 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1s4e n ARG 279 N -2.19 -5.15 0.00 2.98 1.74 -0.00 -4.92 116.66 109.12 1s4e n ARG 279 Ca 0.05 0.65 0.00 0.00 -0.77 0.00 0.00 57.85 57.78 1s4e n ARG 279 Cb 0.43 -5.27 0.00 0.00 -1.02 0.00 0.00 32.46 26.59 1s4e n ARG 279 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1s4e n VAL 280 N -4.28 0.62 -0.93 1.55 0.24 -1.17 -5.01 118.33 109.34 1s4e n VAL 280 Ca -0.29 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 61.32 1s4e n VAL 280 Cb 0.67 0.74 0.00 0.00 -1.47 0.00 0.00 33.84 33.78 1s4e n VAL 280 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1s4e n SER 281 N -0.31 0.00 -3.70 -1.34 2.88 -1.26 0.03 113.62 109.92 1s4e n SER 281 Ca 0.00 -0.45 -0.04 0.00 -1.33 0.00 0.00 58.87 57.05 1s4e n SER 281 Cb 0.26 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.71 1s4e n SER 281 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1s4e h GLU 283 N 2.00 0.02 0.04 0.00 4.57 -2.00 -1.80 114.58 117.42 1s4e h GLU 283 Ca -0.24 -0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.69 1s4e h GLU 283 Cb 1.23 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.79 1s4e h GLU 283 CO 0.26 0.02 -1.25 1.05 -1.18 0.00 0.00 179.01 177.91 1s4e h GLU 284 N 0.03 0.09 -0.58 1.92 9.09 -1.99 -1.76 114.58 121.37 1s4e h GLU 284 Ca 0.59 -0.16 -0.04 0.00 0.05 0.00 0.00 59.36 59.80 1s4e h GLU 284 Cb 1.20 0.06 -0.03 0.00 -1.65 0.00 0.00 28.75 28.33 1s4e h GLU 284 CO -0.89 0.98 0.21 -0.07 0.05 0.00 0.00 179.01 179.29 1s4e h LEU 285 N 0.03 0.83 -1.25 3.06 3.38 -1.83 -2.89 115.31 116.64 1s4e h LEU 285 Ca -0.12 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 1s4e h LEU 285 Cb 1.89 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 1s4e h LEU 285 CO 0.14 0.80 -0.36 0.44 0.09 0.00 0.00 178.44 179.54 1s4e h ASP 286 N 0.82 0.00 0.29 -0.43 3.32 -1.23 -2.04 116.42 117.14 1s4e h ASP 286 Ca 0.19 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 1s4e h ASP 286 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1s4e h ASP 286 CO -0.01 0.36 -0.14 0.15 -1.72 0.00 0.00 179.24 177.88 1s4e h PHE 287 N 0.00 -0.36 -0.60 4.55 3.04 -1.27 -2.49 116.94 119.81 1s4e h PHE 287 Ca -0.00 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.04 1s4e h PHE 287 Cb 0.68 0.12 -0.08 0.00 2.56 0.00 0.00 35.95 39.23 1s4e h PHE 287 CO 0.00 -0.15 0.20 0.35 -2.02 0.00 0.00 178.31 176.69 1s4e h PHE 288 N -0.51 0.33 0.03 0.41 3.57 -1.20 0.38 116.94 119.96 1s4e h PHE 288 Ca -0.04 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1s4e h PHE 288 Cb 0.38 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1s4e h PHE 288 CO -0.03 0.06 -0.02 0.28 -2.23 0.00 0.00 178.31 176.38 1s4e h VAL 289 N 0.36 1.19 -0.24 1.41 2.07 -1.33 -1.38 116.25 118.33 1s4e h VAL 289 Ca 0.31 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 1s4e h VAL 289 Cb 0.41 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1s4e h VAL 289 CO -0.33 0.18 -0.07 0.11 0.02 0.00 0.00 177.57 177.47 1s4e h LYS 290 N -0.34 0.37 0.00 1.57 6.56 -1.00 -2.63 116.57 121.10 1s4e h LYS 290 Ca -0.00 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1s4e h LYS 290 Cb 0.32 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.93 1s4e h LYS 290 CO 0.01 0.46 0.00 0.87 -2.06 0.00 0.00 179.45 178.73 1s4e h LYS 291 N 0.36 0.00 -0.98 3.15 1.57 -0.71 -2.74 116.57 117.21 1s4e h LYS 291 Ca 0.07 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.57 1s4e h LYS 291 Cb 0.36 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.50 1s4e h LYS 291 CO 0.02 0.00 0.36 0.00 -0.57 0.00 0.00 179.45 179.26 1s4e n ALA 292 N -1.93 4.26 0.00 3.86 0.00 -0.54 -2.80 120.51 123.35 1s4e n ALA 292 Ca 0.04 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.82 1s4e n ALA 292 Cb 0.44 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1s4e n ALA 292 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1s4e n GLU 294 N -0.42 0.00 -0.22 0.00 1.02 -1.03 -0.88 120.64 119.11 1s4e n GLU 294 Ca 0.34 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.56 1s4e n GLU 294 Cb 1.17 0.00 0.23 0.00 -0.02 0.00 0.00 31.44 32.81 1s4e n GLU 294 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1s4e n LEU 295 N 0.00 2.51 0.00 -4.62 7.99 -1.12 -4.93 117.00 116.83 1s4e n LEU 295 Ca 0.00 -1.23 0.00 0.00 -0.01 0.00 0.00 56.01 54.77 1s4e n LEU 295 Cb 0.00 -0.29 0.00 0.00 -0.11 0.00 0.00 43.42 43.02 1s4e n LEU 295 CO 0.00 0.61 0.00 0.61 -1.51 0.00 0.00 177.39 177.10 1s4e n GLY 296 N 1.26 0.65 3.56 -0.72 0.00 -1.01 -4.99 105.19 103.94 1s4e n GLY 296 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1s4e n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s4e n ALA 297 N -1.32 -0.27 0.04 4.61 0.00 -0.06 -4.90 120.51 118.60 1s4e n ALA 297 Ca 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 53.44 53.32 1s4e n ALA 297 Cb 0.00 -2.01 -0.04 0.00 0.00 0.00 0.00 19.45 17.40 1s4e n ALA 297 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1s4e h TYR 298 N 0.51 0.77 -2.27 0.00 0.99 -1.46 -3.48 116.97 112.02 1s4e h TYR 298 Ca -0.47 -0.38 0.12 0.00 2.00 0.00 0.00 58.73 60.00 1s4e h TYR 298 Cb 1.37 -0.10 -0.15 0.00 1.00 0.00 0.00 36.73 38.85 1s4e h TYR 298 CO 0.36 1.19 0.50 0.20 -0.00 0.00 0.00 178.16 180.41 1s4e s GLY 299 N -4.30 -0.44 -0.01 3.88 0.00 -1.24 -3.71 107.32 101.50 1s4e s GLY 299 Ca -0.07 0.93 -0.26 0.00 0.00 0.00 0.00 44.72 45.31 1s4e s GLY 299 CO 0.88 0.30 0.59 0.00 0.00 0.00 0.00 173.10 174.87 1s4e s ALA 300 N -3.13 -1.52 -0.29 3.20 0.00 -1.26 -1.25 121.76 117.52 1s4e s ALA 300 Ca 0.06 0.96 -0.18 0.00 0.00 0.00 0.00 51.96 52.80 1s4e s ALA 300 Cb -0.01 0.15 0.14 0.00 0.00 0.00 0.00 23.12 23.40 1s4e s ALA 300 CO -0.08 -0.41 0.98 0.50 0.00 0.00 0.00 175.76 176.75 1s4e s ARG 301 N -1.65 0.43 0.40 0.00 3.52 -0.79 -3.98 118.95 116.87 1s4e s ARG 301 Ca -0.09 0.67 -0.25 0.00 -0.13 0.00 0.00 55.73 55.93 1s4e s ARG 301 Cb -0.01 0.12 -0.11 0.00 -1.56 0.00 0.00 34.95 33.39 1s4e s ARG 301 CO 0.05 -0.08 1.10 1.47 -0.81 0.00 0.00 175.30 177.03 1s4e n LEU 302 N 3.36 2.95 -4.49 -0.88 -0.00 -1.26 -1.16 117.00 115.52 1s4e n LEU 302 Ca -0.17 1.09 -0.24 0.00 -0.00 0.00 0.00 56.01 56.68 1s4e n LEU 302 Cb 0.57 -1.39 -0.10 0.00 -0.00 0.00 0.00 43.42 42.50 1s4e n LEU 302 CO 0.02 -1.18 -0.46 0.28 -0.00 0.00 0.00 177.39 176.05 1s4e s THR 303 N -1.21 2.42 0.00 1.47 -1.32 -0.92 -4.80 115.64 111.27 1s4e s THR 303 Ca 0.61 -2.36 0.00 0.00 -1.21 0.00 0.00 61.69 58.73 1s4e s THR 303 Cb -0.56 -2.37 0.00 0.00 -1.51 0.00 0.00 72.50 68.05 1s4e s THR 303 CO 0.58 -0.36 0.00 0.61 -2.21 0.00 0.00 174.62 173.24 1s4e n GLY 304 N -0.66 -0.78 0.09 6.08 0.00 -1.26 -4.24 105.19 104.41 1s4e n GLY 304 Ca -0.05 -1.21 -0.03 0.00 0.00 0.00 0.00 46.02 44.73 1s4e n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s4e h ALA 305 N 0.00 0.50 0.00 4.61 0.00 -1.93 -3.45 119.26 118.99 1s4e h ALA 305 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1s4e h ALA 305 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1s4e h ALA 305 CO 0.00 1.04 0.00 0.41 0.00 0.00 0.00 179.25 180.70 1s4e n GLY 306 N 1.32 -1.17 3.02 0.00 0.00 -1.26 -4.92 105.19 102.17 1s4e n GLY 306 Ca -0.01 -2.11 -0.21 0.00 0.00 0.00 0.00 46.02 43.69 1s4e n GLY 306 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1s4e n PHE 307 N 0.00 -1.99 0.00 1.61 3.01 0.10 -4.49 117.46 115.70 1s4e n PHE 307 Ca 0.00 0.58 0.00 0.00 1.01 0.00 0.00 57.45 59.04 1s4e n PHE 307 Cb 0.00 -4.35 0.00 0.00 -0.01 0.00 0.00 39.48 35.12 1s4e n PHE 307 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1s4e n GLY 308 N -1.56 0.29 7.00 1.37 0.00 -1.26 -4.11 105.19 106.93 1s4e n GLY 308 Ca -0.08 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.07 1s4e n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s4e n GLY 309 N 0.00 0.80 3.64 -0.02 0.00 -0.52 -4.89 105.19 104.20 1s4e n GLY 309 Ca 0.00 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.96 1s4e n GLY 309 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s4e s SER 310 N -4.00 4.30 0.37 1.61 0.01 -1.17 -1.63 113.70 113.20 1s4e s SER 310 Ca 0.00 -0.87 0.04 0.00 1.31 0.00 0.00 55.95 56.42 1s4e s SER 310 Cb 0.00 -0.62 -0.04 0.00 0.21 0.00 0.00 66.02 65.57 1s4e s SER 310 CO 0.00 -0.16 0.12 0.00 0.41 0.00 0.00 173.24 173.61 1s4e s ALA 311 N -2.45 2.58 0.12 1.44 0.00 -1.05 -2.17 121.76 120.22 1s4e s ALA 311 Ca 0.34 -1.53 0.04 0.00 0.00 0.00 0.00 51.96 50.81 1s4e s ALA 311 Cb -0.02 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 23.88 1s4e s ALA 311 CO 0.20 -0.37 -0.11 0.96 0.00 0.00 0.00 175.76 176.44 1s4e s ILE 312 N -3.32 1.08 -0.14 0.00 -4.36 -0.31 -1.98 121.20 112.16 1s4e s ILE 312 Ca 0.29 -1.82 -0.06 0.00 -0.26 0.00 0.00 60.65 58.79 1s4e s ILE 312 Cb 0.04 -1.58 0.06 0.00 1.25 0.00 0.00 42.46 42.23 1s4e s ILE 312 CO 0.15 -0.62 0.32 0.00 0.24 0.00 0.00 174.94 175.03 1s4e s ALA 313 N -2.78 -0.78 0.03 2.27 0.00 -0.45 -1.88 121.76 118.18 1s4e s ALA 313 Ca 0.10 1.20 -0.25 0.00 0.00 0.00 0.00 51.96 53.01 1s4e s ALA 313 Cb -0.01 -0.92 -0.05 0.00 0.00 0.00 0.00 23.12 22.14 1s4e s ALA 313 CO 0.00 -0.43 0.78 -0.51 0.00 0.00 0.00 175.76 175.61 1s4e s LEU 314 N 1.83 4.43 -0.25 0.00 1.43 -0.38 -1.43 118.68 124.32 1s4e s LEU 314 Ca -0.05 1.45 -0.26 0.00 -1.03 0.00 0.00 54.13 54.23 1s4e s LEU 314 Cb -0.11 -3.25 0.12 0.00 0.03 0.00 0.00 46.19 42.98 1s4e s LEU 314 CO -0.10 -0.02 0.99 -0.69 0.23 0.00 0.00 176.35 176.76 1s4e s VAL 315 N 0.11 0.00 0.26 -1.59 1.01 -1.17 -1.15 120.40 117.87 1s4e s VAL 315 Ca 0.40 0.00 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 1s4e s VAL 315 Cb -0.20 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.07 1s4e s VAL 315 CO 0.23 0.00 1.49 -1.81 0.00 0.00 0.00 175.10 175.01 1s4e s ASP 316 N -0.10 6.55 0.23 3.32 1.01 -1.26 -1.76 116.67 124.67 1s4e s ASP 316 Ca 0.01 2.77 -0.12 0.00 0.71 0.00 0.00 52.55 55.92 1s4e s ASP 316 Cb -0.04 -2.63 0.31 0.00 1.01 0.00 0.00 42.92 41.57 1s4e s ASP 316 CO -0.04 -0.78 1.60 0.50 0.21 0.00 0.00 175.17 176.66 1s4e h LYS 317 N 4.97 -0.02 -0.50 8.23 1.63 -1.81 0.18 116.57 129.24 1s4e h LYS 317 Ca -0.46 0.00 0.09 0.00 -0.85 0.00 0.00 60.65 59.43 1s4e h LYS 317 Cb 1.22 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 32.77 1s4e h LYS 317 CO 0.78 -0.01 0.05 0.22 -3.45 0.00 0.00 179.45 177.04 1s4e h ASP 318 N -0.02 -0.11 -0.31 4.20 1.82 -1.91 -2.65 116.42 117.44 1s4e h ASP 318 Ca 0.36 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 57.11 1s4e h ASP 318 Cb 0.57 0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.75 1s4e h ASP 318 CO -0.80 -0.03 0.00 2.29 -1.61 0.00 0.00 179.24 179.09 1s4e n LYS 319 N -5.18 2.35 0.24 0.28 0.00 -0.71 -4.55 118.16 110.59 1s4e n LYS 319 Ca 0.06 -2.03 0.13 0.00 -0.00 0.00 0.00 58.31 56.47 1s4e n LYS 319 Cb 0.26 -1.49 0.36 0.00 -0.00 0.00 0.00 35.03 34.16 1s4e n LYS 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1s4e h ALA 320 N 4.46 0.98 0.32 0.58 0.00 -0.30 -3.09 119.26 122.21 1s4e h ALA 320 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1s4e h ALA 320 Cb 0.90 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1s4e h ALA 320 CO 0.00 0.05 -0.15 0.87 0.00 0.00 0.00 179.25 180.02 1s4e h LYS 321 N 0.00 -0.41 0.00 0.00 1.57 -1.80 -3.12 116.57 112.80 1s4e h LYS 321 Ca -0.00 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1s4e h LYS 321 Cb 0.84 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.24 1s4e h LYS 321 CO 0.01 -0.10 -0.02 1.15 -0.57 0.00 0.00 179.45 179.91 1s4e h THR 322 N -0.96 0.07 -0.21 -0.16 2.02 -1.90 -2.56 112.91 109.20 1s4e h THR 322 Ca -0.04 -0.53 -0.16 0.00 0.77 0.00 0.00 66.41 66.44 1s4e h THR 322 Cb 0.50 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 1s4e h THR 322 CO 0.07 0.02 -0.53 0.40 0.37 0.00 0.00 175.52 175.86 1s4e h ILE 323 N 0.00 1.31 0.68 3.11 5.03 -1.63 -3.07 117.51 122.94 1s4e h ILE 323 Ca -0.00 -1.76 -0.03 0.00 -0.12 0.00 0.00 64.86 62.95 1s4e h ILE 323 Cb 0.49 1.72 0.01 0.00 -3.03 0.00 0.00 36.82 36.01 1s4e h ILE 323 CO 0.00 0.55 -0.32 1.23 -0.68 0.00 0.00 178.15 178.93 1s4e h GLY 324 N 1.01 -0.95 1.90 5.37 0.00 -1.39 -3.09 103.07 105.92 1s4e h GLY 324 Ca 0.01 0.35 -0.06 0.00 0.00 0.00 0.00 47.33 47.64 1s4e h GLY 324 CO 0.10 -0.34 -0.22 1.29 0.00 0.00 0.00 176.54 177.37 1s4e h ASP 325 N -0.96 0.12 -0.45 0.19 -0.00 -1.63 -1.86 116.42 111.82 1s4e h ASP 325 Ca -0.09 -0.03 -0.13 0.00 -0.00 0.00 0.00 57.03 56.78 1s4e h ASP 325 Cb 0.71 -0.03 -0.01 0.00 -0.00 0.00 0.00 39.33 40.00 1s4e h ASP 325 CO 0.15 0.35 -0.22 0.00 -0.00 0.00 0.00 179.24 179.52 1s4e h ALA 326 N 1.67 0.72 -0.10 4.15 0.00 -1.59 -2.20 119.26 121.90 1s4e h ALA 326 Ca 0.02 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.41 1s4e h ALA 326 Cb 0.46 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1s4e h ALA 326 CO 0.03 0.67 -0.52 0.82 0.00 0.00 0.00 179.25 180.26 1s4e h ILE 327 N 0.84 1.35 0.25 0.00 2.04 -1.41 -3.06 117.51 117.52 1s4e h ILE 327 Ca 0.11 -1.78 -0.01 0.00 1.00 0.00 0.00 64.86 64.18 1s4e h ILE 327 Cb 0.79 1.85 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 1s4e h ILE 327 CO 0.07 0.53 -0.12 -0.07 0.00 0.00 0.00 178.15 178.55 1s4e h LEU 328 N 0.21 -0.29 -0.42 1.44 3.38 -1.06 -1.50 115.31 117.06 1s4e h LEU 328 Ca 0.01 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 57.81 1s4e h LEU 328 Cb 0.98 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.71 1s4e h LEU 328 CO 0.08 0.16 -0.36 -0.09 0.09 0.00 0.00 178.44 178.32 1s4e h ARG 329 N -0.83 -0.26 -0.32 1.13 9.65 -1.52 0.48 114.38 122.71 1s4e h ARG 329 Ca -0.03 0.02 0.05 0.00 -1.10 0.00 0.00 59.98 58.91 1s4e h ARG 329 Cb 0.51 0.06 -0.08 0.00 -1.39 0.00 0.00 29.97 29.07 1s4e h ARG 329 CO 0.06 -0.17 -0.50 1.49 2.80 0.00 0.00 179.97 183.64 1s4e h GLU 330 N -0.27 -0.41 0.00 0.20 4.57 -1.54 -2.37 114.58 114.76 1s4e h GLU 330 Ca 0.17 0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 58.32 1s4e h GLU 330 Cb 0.56 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.23 1s4e h GLU 330 CO -0.57 -0.28 -0.27 -0.92 -1.18 0.00 0.00 179.01 175.80 1s4e h TYR 331 N -0.43 0.00 -0.02 0.92 -0.00 -0.58 -2.66 116.97 114.20 1s4e h TYR 331 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.82 1s4e h TYR 331 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.35 1s4e h TYR 331 CO -0.64 0.27 0.00 1.47 -0.00 0.00 0.00 178.16 179.26 1s4e n LEU 332 N -3.56 0.56 -0.06 2.82 -0.00 0.16 -2.60 117.00 114.32 1s4e n LEU 332 Ca -0.01 -0.20 -0.11 0.00 -0.00 0.00 0.00 56.01 55.70 1s4e n LEU 332 Cb 0.42 -0.01 -0.05 0.00 -0.00 0.00 0.00 43.42 43.77 1s4e n LEU 332 CO 0.34 0.10 -0.92 0.00 -0.00 0.00 0.00 177.39 176.91 1s4e n ALA 333 N -0.52 1.90 0.19 1.47 0.00 -1.02 -4.70 120.51 117.82 1s4e n ALA 333 Ca 0.20 -0.52 -0.14 0.00 0.00 0.00 0.00 53.44 52.97 1s4e n ALA 333 Cb 0.19 0.26 -0.08 0.00 0.00 0.00 0.00 19.45 19.82 1s4e n ALA 333 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1s4e h LYS 334 N -0.19 -0.45 -6.21 0.00 3.64 -1.60 -3.46 116.57 108.31 1s4e h LYS 334 Ca -0.30 0.03 -0.48 0.00 -1.27 0.00 0.00 60.65 58.63 1s4e h LYS 334 Cb 1.37 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.27 1s4e h LYS 334 CO -0.11 -0.20 -0.38 -0.06 -2.27 0.00 0.00 179.45 176.44 1s4e s PHE 335 N -5.39 2.76 -0.25 1.91 0.40 -1.07 -5.05 117.98 111.29 1s4e s PHE 335 Ca -0.15 -0.44 0.17 0.00 -0.60 0.00 0.00 56.93 55.91 1s4e s PHE 335 Cb 0.03 -2.12 -0.24 0.00 0.51 0.00 0.00 43.02 41.20 1s4e s PHE 335 CO 0.60 -0.10 0.48 -1.13 0.70 0.00 0.00 175.22 175.77 1s4e n SER 336 N -1.55 0.98 -4.51 1.36 3.41 -1.26 -4.53 113.62 107.52 1s4e n SER 336 Ca 0.03 -0.27 -0.38 0.00 -0.26 0.00 0.00 58.87 57.99 1s4e n SER 336 Cb 0.61 1.55 0.04 0.00 -0.26 0.00 0.00 64.21 66.15 1s4e n SER 336 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1s4e n TRP 337 N -1.89 -0.22 -2.94 7.33 7.02 -1.26 -4.85 117.44 120.63 1s4e n TRP 337 Ca -0.01 0.45 -0.44 0.00 -1.02 0.00 0.00 57.50 56.48 1s4e n TRP 337 Cb 0.39 -2.01 -0.00 0.00 -2.42 0.00 0.00 31.31 27.26 1s4e n TRP 337 CO 0.00 0.00 0.00 -1.59 -2.02 0.00 0.00 177.69 174.08 1s4e s LYS 338 N -2.22 4.03 0.92 -0.99 0.00 -1.26 -4.91 119.74 115.30 1s4e s LYS 338 Ca 0.70 -2.47 -0.15 0.00 0.00 0.00 0.00 55.97 54.05 1s4e s LYS 338 Cb -0.45 -5.05 0.16 0.00 0.00 0.00 0.00 37.83 32.49 1s4e s LYS 338 CO 0.53 -1.77 1.27 0.00 0.00 0.00 0.00 175.35 175.38 1s4e s ALA 339 N 1.75 2.32 -0.25 0.59 0.00 -1.26 -4.41 121.76 120.50 1s4e s ALA 339 Ca 0.41 -1.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.07 1s4e s ALA 339 Cb -0.03 -2.84 0.18 0.00 0.00 0.00 0.00 23.12 20.43 1s4e s ALA 339 CO -0.01 -2.23 1.27 0.15 0.00 0.00 0.00 175.76 174.94 1s4e s LYS 340 N -5.77 0.20 0.41 0.00 3.01 -1.04 -4.96 119.74 111.58 1s4e s LYS 340 Ca 0.70 0.05 0.08 0.00 -1.01 0.00 0.00 55.97 55.79 1s4e s LYS 340 Cb -0.06 0.09 -0.03 0.00 -1.01 0.00 0.00 37.83 36.82 1s4e s LYS 340 CO 0.52 -0.06 0.34 1.52 0.51 0.00 0.00 175.35 178.18 1s4e s TYR 341 N -1.02 2.72 -0.24 3.18 -0.85 -1.26 -0.69 117.35 119.19 1s4e s TYR 341 Ca 0.06 -0.48 -0.03 0.00 -0.52 0.00 0.00 57.07 56.10 1s4e s TYR 341 Cb -0.01 -2.10 0.13 0.00 0.38 0.00 0.00 41.96 40.37 1s4e s TYR 341 CO -0.06 -0.05 0.38 -0.06 -1.52 0.00 0.00 175.55 174.25 1s4e s PHE 342 N -2.47 -0.83 0.33 -3.49 0.40 0.67 -4.95 117.98 107.65 1s4e s PHE 342 Ca 0.46 0.82 -0.28 0.00 -0.60 0.00 0.00 56.93 57.33 1s4e s PHE 342 Cb -0.03 0.01 -0.09 0.00 0.51 0.00 0.00 43.02 43.42 1s4e s PHE 342 CO 0.27 -0.73 1.16 0.08 0.70 0.00 0.00 175.22 176.70 1s4e s VAL 343 N 2.54 3.26 -0.12 -0.44 1.01 -1.26 -1.52 120.40 123.87 1s4e s VAL 343 Ca 0.13 1.19 -0.12 0.00 0.00 0.00 0.00 61.98 63.17 1s4e s VAL 343 Cb -0.15 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.53 1s4e s VAL 343 CO -0.16 0.22 0.34 0.54 0.00 0.00 0.00 175.10 176.04 1s4e s VAL 344 N -1.26 0.01 0.09 2.92 0.11 -1.02 -4.97 120.40 116.28 1s4e s VAL 344 Ca 0.50 -0.06 0.07 0.00 -2.93 0.00 0.00 61.98 59.56 1s4e s VAL 344 Cb -0.32 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 33.99 1s4e s VAL 344 CO 0.42 -0.03 -0.11 -1.59 -3.33 0.00 0.00 175.10 170.46 1s4e s LYS 345 N -0.00 2.13 0.70 1.54 -2.85 -1.26 -3.37 119.74 116.63 1s4e s LYS 345 Ca -0.02 -1.01 -0.16 0.00 -1.00 0.00 0.00 55.97 53.78 1s4e s LYS 345 Cb -0.03 -2.30 0.01 0.00 -2.06 0.00 0.00 37.83 33.46 1s4e s LYS 345 CO 0.01 0.51 1.18 -2.30 0.10 0.00 0.00 175.35 174.86 1s4e n PRO 346 N 0.82 0.75 -2.45 1.78 -0.02 -1.26 -2.03 135.00 132.59 1s4e n PRO 346 Ca -0.14 0.32 -0.04 0.00 -2.02 0.00 0.00 63.50 61.62 1s4e n PRO 346 Cb 0.52 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 1s4e n PRO 346 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1s4e n SER 347 N -2.12 -0.07 -4.57 2.55 2.88 0.30 -4.58 113.62 108.01 1s4e n SER 347 Ca 0.15 -1.44 -0.26 0.00 -1.33 0.00 0.00 58.87 55.99 1s4e n SER 347 Cb 0.49 0.32 0.12 0.00 -0.75 0.00 0.00 64.21 64.39 1s4e n SER 347 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1s4e s ASP 348 N -1.47 4.10 0.00 -3.46 1.01 -1.26 -2.03 116.67 113.56 1s4e s ASP 348 Ca 0.08 0.02 0.29 0.00 0.71 0.00 0.00 52.55 53.65 1s4e s ASP 348 Cb 0.00 -0.37 1.18 0.00 1.01 0.00 0.00 42.92 44.74 1s4e s ASP 348 CO 0.05 -2.05 1.82 0.61 0.21 0.00 0.00 175.17 175.81